Structure Database (LMSD)

LM_ID Common Name Systematic Name Main class Sub class Mass Formula
LMST03020677 3-Deoxy-3-azido-25-hydroxyvitamin D3 (5Z,7E)-(3S)-3-azido-9,10-seco-5,7,10(19)-cholestatrien-25-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 425.34 C27H43N3O
LMST03020618 3-Deoxyvitamin D3 (5Z,7E)-9,10-seco-5,7,10(19)-cholestatriene Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 368.34 C27H44
LMST03020658 3-Fluoro-9,10-secocholesta-5,7,10(19)-triene (5Z,7E)-(3S)-3-fluoro-9,10-seco-5,7,10(19)-cholestatriene Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 386.33 C27H43F
LMST03020648 3-epi-vitamin D3 (5Z,7E)-(3R)-9,10-seco-5,7,10(19)-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 384.34 C27H44O
LMST03020219 3-epivitamin D3 (5Z,7E)-(3R)-9,10-seco-5,7,10(19)-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 384.34 C27H44O
LMST03020142 4,4-difluoro-1alpha,25-dihydroxyvitamin D3 (5E,7E)-(1S,3S)-4,4-difluoro-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 452.31 C27H42O3F2
LMST03020138 4,4-difluoro-1alpha-hydroxyvitamin D3 (5E,7E)-(1S,3S)-4,4-difluoro-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 436.32 C27H42O2F2
LMST03020134 4,4-difluorovitamin D3 (5E,7E)-(3S)-4,4-difluoro-9,10-seco-5,7,10(19)-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 420.32 C27H42OF2
LMST03020655 5,6-trans-25-Hydroxyvitamin D3 (5E,7Z)-(3S)-9,10-seco-5,7,10(19)-cholestatriene-3,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 400.33 C27H44O2
LMST03020087 6,19-epidioxy-26,26,26,27,27,27-hexafluoro-25-hydroxy-6,19-dihydrovitamin D3 (7E)-(3S)-6,19-epidioxy-26,26,26,27,27,27-hexafluoro-9,10-seco-5(10),7-cholestadiene-3,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 540.27 C27H38O4F6
LMST03020197 6-fluorovitamin D3 (5E,7E)-(3S)-6-fluoro-9,10-seco-5,7,10(19)-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 402.33 C27H43OF
LMST03020333 6-methylprevitamin D3 / 6-methylprecholecalciferol (6E)-(3S)-6-methyl-9,10-seco-5(10),6,8-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 398.35 C28H46O
LMST03020331 6-methylvitamin D3 (5Z,7E)-(3S)-6-methyl-9,10-seco-5,7,10(19)-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 398.35 C28H46O
LMST03020672 7-Dehydrocholesterol 5,6-oxide 5beta,6beta-epoxy-cholest-7-ene-3beta-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 400.33 C27H44O2
LMST03020683 Atocalcitol (5Z,7E)-(1S,3R)-23-oxa-24-[3-(1-hydroxy-1-methylethyl)phenyl]-25,26,27-trinor-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 494.34 C32H46O4
LMST03020615 C-9,11,21-Trisnor-17-methyl-1alpha,25-dihydroxyvitamin D3 (7E)-(1R,3R)-9,11,21-trinor-9,10-seco-5,7-cholestadien-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 378.31 C24H42O3
LMST03020021 Cholacalcioic acid (5Z,7E)-(3S)-3-hydroxy-9,10-seco-5,7,10(19)-cholatrien-24-oic acid Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 372.27 C24H36O3
LMST03020307 Dihydrotachysterol 3 (5E,7E)-(3S,10S)-9,10-seco-5,7-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 386.35 C27H46O
LMST03020642 EB 1129 (5Z,7E,22E,24E)-(1S,3R)-26,27-dimethyl-24a-homo-9,10-seco-5,7,10(19),22,24-cholestapentaene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 454.34 C30H46O3
LMST03020682 EB 1213 (5Z,7E)-(1S,3R)-23-oxa-23-[3-(1-hydroxy-1-methylethyl)phenyl]-24,25,26,27-tetranor-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 480.32 C31H44O4
LMST03020681 Ecalcidene (5Z,7E)-(1S,3R)-24-oxo-25-aza-26,27-propano-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 455.34 C29H45NO3
LMST03020614 GS 1500 (5Z,7E)-(1S,3R)-23-aza-23-[3-(1-hydroxy-1-methylethyl)-phenyl]-24,25,26,27-tetranor-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 496.3 C31H44O3S
LMST03020694 Sibogol D 3-hydroxy-9,10-seco-1,3,5(10)24-cholestatetraen-9-one Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 396.3 C27H40O2
LMST03020690 Subergorgiaol A 9,10-seco-1,3,5(10)-cholestatrien-3,8beta,9alpha-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 416.33 C27H44O3
LMST03020691 Subergorgiaol B 9,10-seco-1,3,5(10),22E-cholestatetraen-3,8beta,9alpha-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 414.31 C27H42O3
LMST03020692 Subergorgiaol H 9,10-seco-1,3,5(10),22E-cholestatetraen-3,8beta,9alpha,15beta-tetraol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.31 C27H42O4
LMST03020693 Subergorgiaol J 3,8beta-dihydroxy-9,10-seco-1,3,5(10)-cholestatrien-9-one Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 414.31 C27H42O3
LMST03020443 Toxisterol3 B3 (5Z,7E)-(3S,10R)-10-ethoxy-9,10-seco-5,7-cholestadien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.38 C29H50O2
LMST03020308 Toxisterol3 R1 (7E)-(3S)-9,10-seco-5(10),7-cholestadien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 386.35 C27H46O
LMST03020641 VD 2656 (7E,16Z)-(1S,3R,20R)-23-thia-24,24b-benzyl-19-nor-24a,24b-dihomo-9,10-seco-5,7,16-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 482.29 C30H42O3S
LMST03020640 VD 2716 (7E,16Z)-(1S,3R)-23-thia-24,24b-clycobenzyl-19-nor-24a,24b-dihomo-9,10-seco-5,7,16-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 482.29 C30H42O3S
LMST03020643 VD 2728 (5Z,7E,16Z,22E,24E)-(1S,3R)-26,27-dimethyl-24a-homo-9,10-seco-5,7,10(19),22,24-cholestahexaene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 452.33 C30H44O3
LMST03020644 VD 2736 (5Z,7E,16Z,22E,24E)-(1S,3R,20S)-26,27-dimethyl-24a-homo-9,10-seco-5,7,10(19),22,24-cholestahexaene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 452.33 C30H44O3
LMST03020001 Vitamin D3 (5Z,7E)-(3S)-9,10-seco-5,7,10(19)-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 384.34 C27H44O
LMST03020654 Vitamin D3 butyrate (5Z,7E)-(3S)-9,10-seco-5,7,10(19)-cholestatrien-3-butanoate Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 454.38 C31H50O2
LMST03020610 Vitamin D3 glucosiduronate (5Z,7E)-(3S)-9,10-seco-5,7,10(19)-cholestatrien-3-glucosiduronate Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 560.37 C33H52O7
LMST03020653 Vitamin D3 palmitate (5Z,7E)-(3S)-9,10-seco-5,7,10(19)-cholestatriene-3-yl hexadecanoate Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 622.57 C43H74O2
LMST03020652 Vitamin D3 sulfoconjugate (5Z,7E)-(3S)-9,10-seco-5,7,10(19)-cholestatrien-3-sulfonic acid Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 464.3 C27H44O4S
LMST03020621 ZK 159222 (5Z,7E,22E)-(1S,3R,24R)-25-carbobutoxy-26,26-cyclo-9,10-seco-5,7,10(19),22-cholestatetraene-1,3,24-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 512.35 C32H48O5
LMST03020622 ZK 168281 (5Z,7E,22E)-(1S,3R,24R)-25-(carboethoxy-methylene)-26,26-cyclo-9,10-seco-5,7,10(19),22-cholestatetraene-1,3,24-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 510.33 C32H46O5
LMST03020242 astrogorgiadiol B (8S,9R)-9,10-seco-1,3,5(10)-cholestatriene-3,9-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 400.33 C27H44O2
LMST03020686 calcitetrol (1S,3R,5Z,7E,24R,25)-9,10-secocholesta-5,7,10(19)-triene-1,3,24,25-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 432.32 C27H44O4
LMST03020605 calicoferol A (22E)-(8S)-3-hydroxy-9,10-seco-1,3,5(10),22-cholestatetraen-9-one Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 396.3 C27H40O2
LMST03020180 calicoferol B (8S,16S)-3,16-dihydroxy-9,10-seco-1,3,5(10)-cholestatrien-9-one Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 414.31 C27H42O3
LMST03020313 calicoferol D (22E)-(8S)-3-hydroxy-22-methyl-9,10-seco-1,3,5(10),22-cholestatetraen-9-one Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 410.32 C28H42O2
LMST03020157 calicoferol E (8S)-3-hydroxy-9,10-seco-1,3,5(10)-cholestatrien-9-one Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 398.32 C27H42O2
LMST03020224 isotachysterol3 (6E)-(3S)-9,10-seco-5(10),6,8(14)-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 384.34 C27H44O
LMST03020222 previtamin D3 (6Z)-(3S)-9,10-seco-5(10),6,8-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 384.34 C27H44O
LMST03020223 tachysterol3 (6E)-(3S)-9,10-seco-5(10),6,8-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 384.34 C27H44O
LMST03020441 toxisterol3 B1 (5E,7E)-(3S,10R)-10-ethoxy-9,10-seco-5,7-cholestadien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.38 C29H50O2