Structure Database (LMSD)

LM_ID Common Name Systematic Name Main class Sub class Mass Formula
LMST03020438 (22R)-1alpha,22,25-trihydroxy-26,27-dimethyl-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22R)-26,27-dimethyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 460.36 C29H48O4
LMST03020517 (22R)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,23,24,24-tetradehydro-24a,24b,24c-trihomovitamin D3 (5Z,7E)-(1S,3R,22R)-26,27-dimethyl-24a,24b,24c-trihomo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 498.37 C32H50O4
LMST03020488 (22R)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,23,24,24-tetradehydro-24a,24b-dihomovitamin D3 (5Z,7E)-(1S,3R,22R)-26,27-dimethyl-24a,24b-dihomo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 484.36 C31H48O4
LMST03020401 (22R)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,24-tetradehydro-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22R)-26,27-dimethyl-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 456.32 C29H44O4
LMST03020516 (22R)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,24-tetradehydro-24a,24b,24c-trihomo-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22R)-26,27-dimethyl-24a,24b,24c-trihomo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 498.37 C32H50O4
LMST03020491 (22R)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,24-tetradehydro-24a,24b-dihomo-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22R)-26,27-dimethyl-24a,24b-dihomo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 484.36 C31H48O4
LMST03020454 (22R)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,24-tetradehydro-24a-homo-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22R)-26,27-dimethyl-24a-homo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 470.34 C30H46O4
LMST03020507 (22R)-1alpha,22,25-trihydroxy-26,27-dimethyl-24a,24b-dihomo-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22R)-26,27-dimethyl-24a,24b-dihomo-9,10-seco-5,7,10(19)-cholestatriene-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 488.39 C31H52O4
LMST03020474 (22R)-1alpha,22,25-trihydroxy-26,27-dimethyl-24a-homo-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22R)-26,27-dimethyl-24a-homo-9,10-seco-5,7,10(19)-cholestatriene-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 474.37 C30H50O4
LMST03020485 (22R)-1alpha,25-dihydroxy-22-methoxy-26,27-dimethyl-23,23,24,24-tetradehydro-24a-homovitamin D3 (5Z,7E)-(1S,3R,22R)-22-methoxy-26,27-dimethyl-24a-homo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 484.36 C31H48O4
LMST03020452 (22R)-1alpha,25-dihydroxy-22-methoxy-26,27-dimethyl-23,23,24,24-tetradehydrovitamin D3 (5Z,7E)-(1S,3R,22R)-22-methoxy-26,27-dimethyl-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 470.34 C30H46O4
LMST03020269 (22R)-22,25-dihydroxyvitamin D3 (5Z,7E)-(3S,22R)-9,10-seco-5,7,10(19)-cholestatriene-3,22,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 416.33 C27H44O3
LMST03020015 (22R)-22-hydroxy-24,25,26,27-tetranorvitamin D3 (5Z,7E)-(3S,22R)- 24-nor-9,10-seco-5,7,10(19)-cholatriene-3,22-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 344.27 C23H36O2
LMST03020342 (22R)-25-hydroxy-22-methoxyvitamin D3 (5Z,7E)-(3S,22R)-22-methoxy-9,10-seco-5,7,10(19)-cholestatriene-3,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020400 (22S)-1alpha,22,25-trihydroxy-23,24-tetradehydro-24a,24b-dihomo-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22S)-24a,24b-dihomo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 456.32 C29H44O4
LMST03020315 (22S)-1alpha,22,25-trihydroxy-23,24-tetradehydro-24a-homo-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22S)-24a-homo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 442.31 C28H42O4
LMST03020519 (22S)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,23,24,24-tetradehydro-24a,24b,24c-trihomovitamin D3 (5Z,7E)-(1S,3R,22S)-26,27-dimethyl-24a,24b,24c-trihomo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 498.37 C32H50O4
LMST03020489 (22S)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,23,24,24-tetradehydro-24a,24b-dihomovitamin D3 (5Z,7E)-(1S,3R,22S)-26,27-dimethyl-24a,24b-dihomo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 484.36 C31H48O4
LMST03020455 (22S)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,23,24,24-tetradehydro-24a-homovitamin D3 (5Z,7E)-(1S,3R,22S)-26,27-dimethyl-24a-homo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 470.34 C30H46O4
LMST03020398 (22S)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,23,24,24-tetradehydrovitamin D3 (5Z,7E)-(1S,3R,22S)-26,27-dimethyl-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 456.32 C29H44O4
LMST03020518 (22S)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,24-tetradehydro-24a,24b,24c-trihomo-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22S)-26,27-dimethyl-24a,24b,24c-trihomo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 498.37 C32H50O4
LMST03020490 (22S)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,24-tetradehydro-24a,24b-dihomo-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22S)-26,27-dimethyl-24a,24b-dihomo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 484.36 C31H48O4
LMST03020456 (22S)-1alpha,22,25-trihydroxy-26,27-dimethyl-23,24-tetradehydro-24a-homo-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22S)-26,27-dimethyl-24a-homo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 470.34 C30H46O4
LMST03020504 (22S)-1alpha,22,25-trihydroxy-26,27-dimethyl-24a,24b-dihomovitamin D3 (5Z,7E)-(1S,3R,22S)-26,27-dimethyl-24a,24b-dihomo-9,10-seco-5,7,10(19)-cholestatriene-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 488.39 C31H52O4
LMST03020476 (22S)-1alpha,22,25-trihydroxy-26,27-dimethyl-24a-homovitamin D3 (5Z,7E)-(1S,3R,22S)-26,27-dimethyl-24a-homo-9,10-seco-5,7,10(19)-cholestatriene-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 474.37 C30H50O4
LMST03020439 (22S)-1alpha,22,25-trihydroxy-26,27-dimethylvitamin D3 (5Z,7E)-(1S,3R,22S)-26,27-dimethyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,22,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 460.36 C29H48O4
LMST03020487 (22S)-1alpha,25-dihydroxy-22-ethoxy-26,27-dimethyl-23,24-tetradehydro-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22S)-26,27-dimethyl-22-ethoxy-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 484.36 C31H48O4
LMST03020515 (22S)-1alpha,25-dihydroxy-22-ethoxy-26,27-dimethyl-23,24-tetradehydro-24a-homo-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22S)-26,27-dimethyl-22-ethoxy-24a-homo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 498.37 C32H50O4
LMST03020453 (22S)-1alpha,25-dihydroxy-22-methoxy-26,27-dimethyl-23,24-tetradehydro-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22S)-26,27-dimethyl-22-methoxy-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 470.34 C30H46O4
LMST03020486 (22S)-1alpha,25-dihydroxy-22-methoxy-26,27-dimethyl-23,24-tetradehydro-24a-homo-20-epivitamin D3 (5Z,7E)-(1S,3R,20R,22S)-26,27-dimethyl-22-methoxy-24a-homo-9,10-seco-5,7,10(19)-cholestatrien-23-yne-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 484.36 C31H48O4
LMST03020270 (22S)-22,25-dihydroxyvitamin D3 (5Z,7E)-(3S,22S)-9,10-seco-5,7,10(19)-cholestatriene-3,22,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 416.33 C27H44O3
LMST03020016 (22S)-22-hydroxy-24,25,26,27-tetranorvitamin D3 (5Z,7E)-(3S,22S)- 24-nor-9,10-seco-5,7,10(19)-cholatriene-3,22-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 344.27 C23H36O2
LMST03020243 (22S)-22-hydroxyvitamin D3 (5Z,7E)-(3S,22S)-9,10-seco-5,7,10(19)-cholestatriene-3,22-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 400.33 C27H44O2
LMST03020343 (22S)-25-hydroxy-22-methoxyvitamin D3 (5Z,7E)-(3S,22S)-22-methoxy-9,10-seco-5,7,10(19)-cholestatriene-3,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020461 (22Z)-1alpha,25-dihydroxy-26,27-dimethyl-22,23-didehydro-24a-homo-20-epivitamin D3 (5Z,7E,22Z)-(1S,3R,20S)-26,27-dimethyl-24a-homo-9,10-seco-5,7,10(19),22-cholestatetraene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 456.36 C30H48O3
LMST03020150 (22Z)-1alpha-hydroxy-22,23-didehydrovitamin D3 (5Z,7E,22Z)-(1S,3R)-9,10-seco-5,7,10(19),22-cholestatetraene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 398.32 C27H42O2
LMST03020151 (22Z)-1beta-hydroxy-22,23-didehydrovitamin D3 (5Z,7E,22Z)-(1R,3R)-9,10-seco-5,7,10(19),22-cholestatetraene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 398.32 C27H42O2
LMST03020109 (23E)-1alpha,25-dihydroxy-16,17,23,24-tetradehydrovitamin D3 (5Z,7E,23E)-(1S,3R)-9,10-seco-5,7,10(19),16,23-cholestapentaene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 412.3 C27H40O3
LMST03020173 (23E)-1alpha,25-dihydroxy-23,24-didehydrovitamin D3 (5Z,7E,23E)-(1S,3R)-9,10-seco-5,7,10(19),23-cholestatetraene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 414.31 C27H42O3
LMST03020083 (23E)-26,26,26,27,27,27-hexafluoro-1alpha,25-dihydroxy-23,24-didehydrovitamin D3 (5Z,7E,23E)-(1S,3R)-26,26,26,27,27,27-hexafluoro-9,10-seco-5,7,10(19),23-cholestatetraene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 522.26 C27H36O3F6
LMST03020389 (23R)-1alpha,23,25-trihydroxy-23-methylvitamin D3 (5Z,7E)-(1S,3R,23R)-23-methyl-9,10-seco-5,7,10(19)-cholestatrien-1,3,23,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 446.34 C28H46O4
LMST03020194 (23R)-1alpha,23,25-trihydroxy-24-oxovitamin D3 (5Z,7E)-(1S,3R,23R)-1,3,23,25-tetrahydroxy-9-10-seco-5,7,10(19)-cholestatrien-24-one Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 446.3 C27H42O5
LMST03020388 (23R)-1alpha,23,25-trihydroxyvitamin D3 / (23R)-1alpha,23,25-trihydroxycholecalciferol (5Z,7E)-(1S,3R,23R)-9,10-seco-5,7,10(19)-cholestatriene-1,3,23,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 432.32 C27H44O4
LMST03020111 (23R)-1alpha,25-dihydroxy-22,23,23,24-tetradehydrovitamin D3 (5Z,7E)-(1S,3R,23R)-9,10-seco-5,7,10(19),22,23-cholestapentaene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 412.3 C27H40O3
LMST03020600 (23R)-1alpha-hydroxy-25,27-didehydrovitamin D3 26,23-lactone (5Z,7E)-(1S,3R,23R)-1,3-dihydroxy-9,10-seco-5,7,10(19),25(27)-cholestatetraeno-26,23-lactone Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 426.28 C27H38O4
LMST03020271 (23R)-23,25-dihydroxyvitamin D3 (5Z,7E)-(3S,23R)-9,10-seco-5,7,10(19)-cholestatriene-3,23,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 416.33 C27H44O3
LMST03020122 (23R,25R)-1alpha,25-dihydroxyvitamin D3 26,23-lactone (5Z,7E)-(1S,3R,23R,25R)-1,3,25-trihydroxy-9,10-seco-5,7,10(19)-cholestatrieno-26,23-lactone Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 444.29 C27H40O5
LMST03020115 (23R,25R)-25-hydroxyvitamin D3 26,23-lactone (5Z,7E)-(3S,23R,25R)-3,25-dihydroxy-9,10-seco-5,7,10(19)-cholestatrieno-26,23-lactone Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 428.29 C27H40O4
LMST03020124 (23R,25S)-1alpha,25-dihydroxyvitamin D3 26,23-lactone (5Z,7E)-(1S,3R,23R,25S)-1,3,25-trihydroxy-9,10-seco-5,7,10(19)-cholestatrieno-26,23-lactone Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 444.29 C27H40O5
LMST03020117 (23R,25S)-25-hydroxyvitamin D3 26,23-lactone (5Z,7E)-(3S,23R,25S)-3,25-dihydroxy-9,10-seco-5,7,10(19)-cholestatrieno-26,23-lactone Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 428.29 C27H40O4