Structure Database (LMSD)

LM_ID Common Name Systematic Name Main class Sub class Mass Formula
LMST03020534 1alpha,25-dihydroxy-2beta-(6-hydroxyhexyl)vitamin D3 (5Z,7E)-(1S,2R,3R)-2-(6-hydroxyhexyl)-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 516.42 C33H56O4
LMST03020509 1alpha,25-dihydroxy-2beta-butoxyvitamin D3 (5Z,7E)-(1R,2R,3R)-2-butoxy-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 488.39 C31H52O4
LMST03020561 1alpha,25-dihydroxy-2beta-hydroxymethyl-19-nor-20-epivitamin D3 (7E)-(1R,2R,3R,20S)-2-hydroxymethyl-19-nor-9,10-seco-5,7-cholestadiene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 434.34 C27H46O4
LMST03020556 1alpha,25-dihydroxy-2beta-hydroxymethyl-19-norvitamin D3 (7E)-(1R,2R,3R)-2-hydroxymethyl-19-nor-9,10-seco-5,7-cholestadiene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 434.34 C27H46O4
LMST03020559 1alpha,25-dihydroxy-2beta-methyl-19-nor-20-epivitamin D3 (7E)-(1R,2R,3R,20S)-2-methyl-19-nor-9,10-seco-5,7-cholestadiene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 418.34 C27H46O3
LMST03020554 1alpha,25-dihydroxy-2beta-methyl-19-norvitamin D3 (7E)-(1R,2R,3R)-2-methyl-19-nor-9,10-seco-5,7-cholestadiene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 418.34 C27H46O3
LMST03020520 1alpha,25-dihydroxy-2beta-pentylvitamin D3 (5Z,7E)-(1S,2R,3R)-2-pentyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 486.41 C32H54O3
LMST03020566 1alpha,25-dihydroxy-3-deoxy-19-nor-22-oxavitamin D3 (7E)-(1S)-19-nor-22-oxa-9,10-seco-5,7-cholestadiene-1,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 390.31 C25H42O3
LMST03020562 1alpha,25-dihydroxy-3-deoxy-19-norvitamin D3 (7E)-(1S)-19-nor-9,10-seco-5,7-cholestadiene-1,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 388.33 C26H44O2
LMST03020041 1alpha,25-dihydroxy-3-deoxy-3-thiavitamin D3 (5E,7E)-(1R)-9,10-seco-3-thia-5,7,10(19)-cholestatriene-1,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 418.29 C26H42O2S
LMST03020049 1alpha,25-dihydroxy-3-deoxy-3-thiavitamin D3 3-oxide (5E,7E)-(1R,3R)-1,25-dihydroxy-9,10-seco-3-thia-5,7,10(19)-cholestatriene 3-oxide Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 434.29 C26H42O3S
LMST03020241 1alpha,25-dihydroxy-3-deoxyvitamin D3 (5Z,7E)-(1S)-9,10-seco-5,7,10(19)-cholestatriene-1,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 400.33 C27H44O2
LMST03020259 1alpha,25-dihydroxy-3-epivitamin D3 (5Z,7E)-(1S,3S)-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 416.33 C27H44O3
LMST03020336 1alpha,25-dihydroxy-3alpha-methyl-3-deoxyvitamin D3 (5Z,7E)-(1S,3S)-3-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 414.35 C28H46O2
LMST03020174 1alpha,25-dihydroxy-6,7-didehydroprevitamin D3 (1S,3R)-9,10-seco-5(10),8-cholestadien-6-yne-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 414.31 C27H42O3
LMST03020347 1alpha,25-dihydroxy-8(14)a-homovitamin D3 (5Z,7E)-(1S,3R)-8(14)a-homo-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020154 1alpha,25-dihydroxy-9,11-didehydro-3-deoxyvitamin D3 / (5Z,7E)-(1S)-9,10-seco-5,7,10(19),9(11)-cholestatetraene-1,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 398.32 C27H42O2
LMST03020170 1alpha,25-dihydroxy-9,11-didehydrovitamin D3 (5Z,7E)-(1S,3R)-9,10-seco-5,7,9(11),10(19)-cholestatetraene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 414.31 C27H42O3
LMST03020258 1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,3R)-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 416.33 C27H44O3
LMST03020076 1alpha,26,26,26,27,27,27-heptafluoro-25-hydroxy-16,17,23,23,24,24-hexadehydrovitamin D3 (5Z,7E)-(1S,3R)-1,26,26,26,27,27,27-heptafluoro-9,10-seco-5,7,10(19),16-cholestatetraen-23-yne-3,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 520.22 C27H31O2F7
LMST03020547 1alpha,2alpha,25-trihydroxy-19-norvitamin D3 (7E)-(1R,2S,3R)-19-nor-9,10-seco-5,7-cholestadiene-1,2,3,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 420.32 C26H44O4
LMST03020548 1alpha,2beta,25-trihydroxy-19-norvitamin D3 (7E)-(1R,2R,3R)-19-nor-9,10-seco-5,7-cholestadiene-1,2,3,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 420.32 C26H44O4
LMST03020572 1alpha-(2-fluoroethyl)-25-hydroxy-26,27-dimethyl-24a-homo-22-oxavitamin D3 (5Z,7E)-(1R,3S)-1-(2-fluoroethyl)-26,27-dimethyl-24a-homo-22-oxa-9,10-seco-5,7,10(19)-cholestatriene-3,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 490.38 C31H51O3F
LMST03020650 1alpha-Hydroxy-2-methylene-19-nor-(20S)-bishomopregnacalciferol (7E)-(1R,3R,20S)-2-methylene-19,nor-20-dihomo-9,10-seco-5,7-pregnadien-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 344.27 C23H36O2
LMST03020661 1alpha-Hydroxypregnacalciferol (5E,7Z)-(1S,3R)-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 400.33 C27H44O2
LMST03020497 1alpha-butyl-1beta,25-dihydroxyvitamin D3 (5Z,7E)-(1R,3R)-1-butyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 472.39 C31H52O3
LMST03020209 1alpha-fluoro-25-hydrovitamin D3 (5Z,7E)-(1S,3R)-3-fluoro-9,10-seco-5,7,10(19)-cholestatriene-3,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 418.32 C27H43O2F
LMST03020084 1alpha-fluoro-25-hydroxy-16,17,23,23,24,24-hexadehydrovitamin D3 (5Z,7E)-(1S,3R)-1-fluoro-9,10-seco-5,7,10(19),16-cholestatetraen-23-yne-3,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 412.28 C27H37O2F
LMST03020592 1alpha-hydroxy-18-(4-hydroxy-4-ethyl-2-hexynyloxy)-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-18-(4-hydroxy-4-ethyl-2-hexynyloxy)-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 470.34 C30H46O4
LMST03020587 1alpha-hydroxy-18-(4-hydroxy-4-ethylhexyloxy)-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-18-(4-hydroxy-4-ethylhexyloxy)-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 474.37 C30H50O4
LMST03020591 1alpha-hydroxy-18-(4-hydroxy-4-methyl-2-pentynyloxy)-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-18-(4-hydroxy-4-methyl-2-pentynyloxy)-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 442.31 C28H42O4
LMST03020586 1alpha-hydroxy-18-(4-hydroxy-4-methylpentyloxy)-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-18-(4-hydroxy-4-methylpentyloxy)-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 446.34 C28H46O4
LMST03020593 1alpha-hydroxy-18-(5-hydroxy-5-methyl-2-hexynyloxy)-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-18-(5-hydroxy-5-methyl-2-hexynyloxy)-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 456.32 C29H44O4
LMST03020594 1alpha-hydroxy-18-(5-hydroxy-5-methyl-3-hexynyloxy)-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-18-(5-hydroxy-5-methyl-3-hexynyloxy)-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 456.32 C29H44O4
LMST03020588 1alpha-hydroxy-18-(5-hydroxy-5-methylhexyloxy)-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-18-(5-hydroxy-5-methylhexyloxy)-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 460.36 C29H48O4
LMST03020590 1alpha-hydroxy-18-[m-(1-hydroxy-1-ethylpropyl)-benzyloxy]-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-18-[m-(1-hydroxy-1-ethylpropyl)-benzyloxy]-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 522.37 C34H50O4
LMST03020589 1alpha-hydroxy-18-[m-(1-hydroxy-1-methylethyl)-benzyloxy]-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-18-[m-(1-hydroxy-1-methylethyl)-benzyloxy]-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 494.34 C32H46O4
LMST03020604 1alpha-hydroxy-20-oxo-19,22,23,24,25,26,27-heptanorvitamin D3 (7E)-(1R,3R)-1,3-dihydroxy-19-nor-9,10-seco-5,7-pregnadien-20-one Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 318.22 C20H30O3
LMST03020003 1alpha-hydroxy-20-oxo-22,23,24,25,26,27-hexanorvitamin D3 (5Z,7E)-(1S,3R)-1,3-dihydroxy-9,10-seco-5,7,10(19)-pregnatrien-20-one Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 330.22 C21H30O3
LMST03020026 1alpha-hydroxy-21-nor-20-oxavitamin D3 (5Z,7E)-(1S,3R)-21-nor-20-oxa-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 388.3 C25H40O3
LMST03020310 1alpha-hydroxy-22-(3-hydroxyphenyl)-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-22-(3-hydroxyphenyl)-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 422.28 C28H38O3
LMST03020390 1alpha-hydroxy-22-(3-methylphenyl)-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-22-(3-methylphenyl)-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 420.3 C29H40O2
LMST03020311 1alpha-hydroxy-22-(4-hydroxyphenyl)-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-22-(4-hydroxyphenyl)-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 422.28 C28H38O3
LMST03020479 1alpha-hydroxy-22-[3-(1-hydroxy-1-methylethyl)phenyl]-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-22-[3-(1-hydroxy-1-methylethyl)phenyl]-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 464.33 C31H44O3
LMST03020044 1alpha-hydroxy-22-oxavitamin D3 (5Z,7E)-(1S,3R)-22-oxa-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 402.31 C26H42O3
LMST03020007 1alpha-hydroxy-22-oxo-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-1,3-dihydroxy-9,10-seco-23,24-dinor-5,7,10(19)-cholatrien-22-one Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 344.24 C22H32O3
LMST03020159 1alpha-hydroxy-22-oxovitamin D3 (5Z,7E)-(1S,3R)-1,3-dihydroxy-9,10-seco-5,7,10(19)-cholestatrien-22-one Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 414.31 C27H42O3
LMST03020009 1alpha-hydroxy-23,24,25,26,27-pentanorvitamin D3 (5Z,7E)-(1S,3R)-23,24-dinor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 330.26 C22H34O2
LMST03020510 1alpha-hydroxy-23-[3-(1-hydroxy-1-methylethyl)phenyl]-22,22,23,23-tetradehydro-24,25,26,27-tetranorvitamin D3 (5Z,7E)-(1S,3R)-23-[3-(1-hydroxy-1-methylethyl)phenyl]-24-nor-9,10-seco-5,7,10(19)-cholatrien-22-yne-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 474.31 C32H42O3
LMST03020014 1alpha-hydroxy-24,25,26,27-tetranorvitamin D3 (5Z,7E)-(1S,3R)-24-nor-9,10-seco-5,7,10(19)-cholatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 344.27 C23H36O2