Structure Database (LMSD)

LM_ID Common Name Systematic Name Main class Sub class Mass Formula
LMST03020503 26,27-diethyl-1alpha,25-dihydroxy-24a-homo-22-oxa-20-epivitamin D3 (5Z,7E)-(1S,3R,20R)-26,27-diethyl-24a-homo-22-oxa-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 488.39 C31H52O4
LMST03020498 26,27-diethyl-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,3R)-26,27-diethyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 472.39 C31H52O3
LMST03020627 2alpha-(3-Hydroxypropyl)-1alpha,25-dihydroxy-19-norvitamin D3 (5Z,7E)-(1R,2R,3R)-3-(hydroxy-propyl)-19-nor-9,10-seco-5,7-cholestadien-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 462.37 C29H50O4
LMST03020551 2alpha-(benzyloxy)-1alpha,25-dihydroxy-19-norvitamin D3 (7E)-(1R,2S,3R)-2-(benzyloxy)-19-nor-9,10-seco-5,7-cholestadiene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 510.37 C33H50O4
LMST03020616 2alpha-Fluoro-19-nor-22-oxa-1alpha,25-dihydroxyvitamin D3 (5E,7E)-(1R,2S,3R)-2-fluoro-22-oxa-19-nor-9,10-seco-5,7-cholestadien-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 424.3 C25H41O4F
LMST03020196 2alpha-chloro-1beta,25-dihydroxyvitamin D3 (5Z,7E)-(1S,2S,3R)-2-chloro-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 450.29 C27H43O3Cl
LMST03020239 2alpha-hydroxyvitamin D3 (5Z,7E)-(2R,3R)-9,10-seco-5,7,10(19)-cholestatriene-2,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 400.33 C27H44O2
LMST03020540 2alpha-methyl-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,2S,3R)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020351 2alpha-methyl-1beta,25-dihydroxyvitamin D3 (5Z,7E)-(1R,2S,3R)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020355 2alpha-methyl-20-epi-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,2S,3R,20S)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020359 2alpha-methyl-20-epi-1beta,25-dihydroxyvitamin D3 (5Z,7E)-(1R,2S,3R,20S)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020349 2alpha-methyl-3-epi-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,2S,3S)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020353 2alpha-methyl-3-epi-1beta,25-dihydroxyvitamin D3 (5Z,7E)-(1R,2S,3S)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020357 2alpha-methyl-3-epi-20-epi-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,2S,3S,20S)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020361 2alpha-methyl-3-epi-20-epi-1beta,25-dihydroxyvitamin D3 (5Z,7E)-(1R,2S,3S,20S)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020601 2beta-chloro-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1R,2R,3R)-2-chloro-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 450.29 C27H43O3Cl
LMST03020602 2beta-fluoro-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1R,2R,3R)-2-fluoro-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 434.32 C27H43O3F
LMST03020240 2beta-hydroxyvitamin D3 (5Z,7E)-(2S,3R)-9,10-seco-5,7,10(19)-cholestatriene-2,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 400.33 C27H44O2
LMST03020603 2beta-methoxy-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1R,2R,3R)-2-methoxy-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 446.34 C28H46O4
LMST03020348 2beta-methyl-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,2R,3R)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020352 2beta-methyl-1beta,25-dihydroxyvitamin D3 (5Z,7E)-(1R,2R,3R)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020356 2beta-methyl-20-epi-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,2R,3R,20S)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020360 2beta-methyl-20-epi-1beta,25-dihydroxyvitamin D3 (5Z,7E)-(1R,2R,3R,20S)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020350 2beta-methyl-3-epi-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,2R,3S)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020354 2beta-methyl-3-epi-1beta,25-dihydroxyvitamin D3 (5Z,7E)-(1R,2R,3S)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020358 2beta-methyl-3-epi-20-epi-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,2R,3S,20S)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020362 2beta-methyl-3-epi-20-epi-1beta,25-dihydroxyvitamin D3 (5Z,7E)-(1R,2R,3S,20S)-2-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.34 C28H46O3
LMST03020684 3'-O-Aminopropyl-25-hydroxyvitamin D3 (5Z,7E)-(3S)-3-(3'-O-amino-propyl)-9,10-seco-5,7,10(19)-cholestatriene-3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 457.39 C30H51NO2
LMST03020619 3-Deoxy-25-hydroxyvitamin D3 (5Z,7E)-9,10-seco-5,7,10(19)-cholestatrien-25-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 384.34 C27H44O
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