Structure Database (LMSD)

LM_ID Common Name Systematic Name Main class Sub class Mass Formula
LMST03020139 (5Z)-4,4-difluoro-1alpha-hydroxyvitamin D3 (5Z,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
LMST03020135 (5Z)-4,4-difluorovitamin D3 (5Z,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
LMST03020204 (5Z,10E)-19-fluoro-1alpha-hydroxyvitamin-D3 (5Z,7E,10E)-(1S,3R)-19-fluoro-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 418.32 C27H43O2F
LMST03020203 (5Z,10Z)-19-fluoro-1alpha-hydroxyvitamin-D3 (5Z,7E,10Z)-(1S,3R)-19-fluoro-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 418.32 C27H43O2F
LMST03020303 (6R)-1alpha,25-dihydroxyvitamin D3 6,19-sulfur dioxide adduct (7E)-(1S,3R,6R)-6,19-epithio-9,10-seco-5(10),7-cholestadiene-1,3,25-triol S,S-dioxide Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 480.29 C27H44O5S
LMST03020279 (6R)-25-hydroxyvitamin D3 6,19-sulfur dioxide adduct (7E)-(3S,6R)-6,19-epithio-9,10-seco-5(10),7-cholestadiene-3,25-diol S,S-dioxide Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 464.3 C27H44O4S
LMST03020302 (6R)-6,19-epidioxy-1alpha,25-dihydroxy-6,19-dihydrovitamin D3 (7E)-(1S,3R)-6,19-epidioxy-9,10-seco-5(10),7-cholestadiene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 448.32 C27H44O5
LMST03020277 (6R)-6,19-epidioxy-1alpha-hydroxy-6,19-dihydrovitamin D3 (7E)-(1S,3R,6R)-6,19-epidioxy-9,10-seco-5(10),7-cholestadiene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 432.32 C27H44O4
LMST03020281 (6R)-6,19-epidioxy-25-hydroxy-6,19-dihydrovitamin D3 (7E)-(3S,6R)-6,19-epidioxy-9,10-seco-5(10),7-cholestadiene-3,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 432.32 C27H44O4
LMST03020248 (6R)-6,19-epidioxy-6,19-dihydrovitamin D3 (7E)-(3S,6R)-6,19-epidioxy-9,10-seco-5(10),7-cholestadien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 416.33 C27H44O3
LMST03020418 (6R)-6,19-ethano-25-hydroxy-6,19-dihydrovitamin D3 (7E)-(3S,6R)-6,19-ethano-9,10-seco-5(10),7-cholestadiene-3,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 428.37 C29H48O2
LMST03020337 (6R)-6-methylvitamin D3 6,19-sulfur dioxide adduct (7E)-(3S,6R)-6-methyl-6,19-epithio-9,10-seco-5(10),7-cholestadien-3-ol S,S-dioxide Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 462.32 C28H46O3S
LMST03020536 (6R)-vitamin D3 6,19-(4-phenyl-1,2,4-triazoline-3,5-dione) adduct (7E)-(3S,6R)-9,10-seco-5,7,10(19)-cholestatrien-3-ol 6,19-(4-phenyl-1,2,4-triazoline-3,5-dione) adduct Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 559.38 C35H49N3O3
LMST03020541 (6R)-vitamin D3 6,19-[4-{2-(6,7-dimethoxy-4-methyl-3-oxo-3,4-dihydroquinoxalinyl)ethyl}-1,2,4-triazoline-3,5-dione] adduct (7E)-(3S,6R)-9,10-seco-5,7,10(19)-cholestatrien-3-ol 6,19-[4-{2-(6,7-dimethoxy-4-methyl-3-oxo-3,4-dihydroquinoxalinyl)ethyl}-1,2,4-triazoline-3,5-dione] adduct Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 729.45 C42H59N5O6
LMST03020250 (6R)-vitamin D3 6,19-sulfur dioxide adduct (7E)-(3S,6R)-6,19-epithio-9,10-seco-5(10),7-cholestadien-3-ol S,S-dioxide Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 448.3 C27H44O3S
LMST03020012 (6RS)-22-hydroxy-23,24,25,26,27-pentanorvitamin D3 6,19-sulfur dioxide adduct (7E)-(3S,6RS)-6,19-epithio-23,24-dinor-9,10-seco-5(10),7-choladiene-3,22-diol S,S-dioxide Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 394.22 C22H34O4S
LMST03020008 (6RS)-22-oxo-23,24,25,26,27-pentanorvitamin D3 6,19-sulfur dioxide adduct (7E)-(3S,6RS)-3-hydroxy-6,19-epithio-23,24-dinor-9,10-seco-5(10),7-choladien-22-al S,S-dioxide Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 392.2 C22H32O4S
LMST03020146 (6RS)-6,19-epidioxy-24,24-difluoro-25-hydroxy-6,19-dihydrovitamin D3 (7E)-(3S, 6RS)-6,19-epidioxy-24,24-difluoro-9,10-seco-5(10),7-cholestadiene-3,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 468.31 C27H42O4F2
LMST03020305 (6RS,24R)-24,25-dihydroxyvitamin D3 6,19-sulfur dioxide adduct (7E)-(3S,6RS,24R)-6,19-epithio-9,10-seco-5(10),7-cholestadiene-3,24,25-triol S,S-dioxide Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 480.29 C27H44O5S
LMST03020304 (6S)-1alpha,25-dihydroxyvitamin D3 6,19-sulfur dioxide adduct (7E)-(1S,3R,6S)-6,19-epithio-9,10-seco-5(10),7-cholestadiene-1,3,25-triol S,S-dioxide Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 480.29 C27H44O5S
LMST03020280 (6S)-25-hydroxyvitamin D3 6,19-sulfur dioxide adduct (7E)-(3S,6S)-6,19-epithio-9,10-seco-5(10),7-cholestadiene-3,25-diol S,S-dioxide Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 464.3 C27H44O4S
LMST03020278 (6S)-6,19-epidioxy-1alpha-hydroxy-6,19-dihydrovitamin D3 (7E)-(1S,3R,6S)-6,19-epidioxy-9,10-seco-5(10),7-cholestadiene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 432.32 C27H44O4
LMST03020282 (6S)-6,19-epidioxy-25-hydroxy-6,19-dihydrovitamin D3 (7E)-(3S,6S)-6,19-epidioxy-9,10-seco-5(10),7-cholestadiene-3,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 432.32 C27H44O4
LMST03020249 (6S)-6,19-epidioxy-6,19-dihydrovitamin D3 (7E)-(3S,6S)-6,19-epidioxy-9,10-seco-5(10),7-cholestadien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 416.33 C27H44O3
LMST03020417 (6S)-6,19-ethano-25-hydroxy-6,19-dihydrovitamin D3 (7E)-(3S,6S)-6,19-ethano-9,10-seco-5(10),7-cholestadiene-3,25-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 428.37 C29H48O2
LMST03020338 (6S)-6-methylvitamin D3 6,19-sulfur dioxide adduct (7E)-(3S,6S)-6-methyl-6,19-epithio-9,10-seco-5(10),7-cholestadien-3-ol S,S-dioxide Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 462.32 C28H46O3S
LMST03020537 (6S)-vitamin D3 6,19-(4-phenyl-1,2,4-triazoline-3,5-dione) adduct (7E)-(3S,6S)-9,10-seco-5,7,10(19)-cholestatrien-3-ol 6,19-(4-phenyl-1,2,4-triazoline-3,5-dionne) adduct Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 559.38 C35H49N3O3
LMST03020542 (6S)-vitamin D3 6,19-[4-{2-(6,7-dimethoxy-4-methyl-3-oxo-3,4-dihydroquinoxalinyl)ethyl}-1,2,4-triazoline-3,5-dione] adduct (7E)-(3S,6S)-9,10-seco-5,7,10(19)-cholestatrien-3-ol 6,19-[4-{2-(6,7-dimethoxy-4-methyl-3-oxo-3,4-dihydroquinoxalinyl)ethyl}-1,2,4-triazoline-3,5-dione] adduct Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 729.45 C42H59N5O6
LMST03020251 (6S)-vitamin D3 6,19-sulfur dioxide adduct (7E)-(3S,6S)-6,19-epithio-9,10-seco-5(10),7-cholestadien-3-ol S,S-dioxide Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 448.3 C27H44O3S
LMST03020666 1,24-Dihydroxy-25-fluorovitamin D3 (5Z,7E)-(1S,3R,24S)-24-fluoro-9,10-seco-5,7,10(19)-cholestatriene-1,3,24-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 434.32 C27H43O3F
LMST03020620 1,25-Dihydroxy-20S-21-(3-hydroxy-3-methylbutyl)-23-yne-26,27-hexafluorovitamin D3 (5Z,7E)-(1S,3R,20S)-21-(3-hydroxy-3-methyl-butyl)-23-yne-26,26,26,27,27,27-hexafluoro-9,10-seco-5,7,10(19)-cholestatrien-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 606.31 C32H44O4F6
LMST03020668 1,25-Dihydroxy-23-oxo-vitamin D3 (5Z,7E)-(1S,3R)-23-oxo-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 430.31 C27H42O4
LMST03020608 1,25-Dihydroxy-24-oxo-16-ene-vitamin D3 (5Z,7E,16Z)-(1S,3R)-24-oxo-9,10-seco-5,7,10(19),16-cholestatetraen-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 428.29 C27H40O4
LMST03020611 1,25-Dihydroxyvitamin D3 3-glycoside (5Z,7E)-(1S,3R)-1,25-dihydroxy-9,10-seco-5,7,10(19)-cholestatrien-3-glycoside Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 578.38 C33H54O8
LMST03020032 1,25-dihydroxy-2,4-dinor-1,3-secovitamin D3 (5Z,7E)-A-dinor-(1,2)-(9,10)-diseco-5,7,10(19)-cholestatriene-1,2,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 390.31 C25H42O3
LMST03020075 1,25-dihydroxy-2-nor-1,2-secovitamin D3 (5Z,7E)-A-nor-(1,2)-(9,10)-diseco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 404.33 C26H44O3
LMST03020657 1-Hydroxyprevitamin D3 (4E,6Z,8Z)-(1S,3R)-4-methyl-9,10-seco-4(5),6,8-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 400.33 C27H44O2
LMST03020659 1-Hydroxyprevitamin D3 diacetate (5E,6Z,8Z)-(1S,3R)-9,10-seco-5(10),6,8-cholestatrien-1,3-diethanoate Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 484.36 C31H48O4
LMST03020671 1-Hydroxyvitamin D3 3-D-glucopyranoside (5Z,7E)-(1S,3R)-9,10-seco-5,7,10(19)-cholestatrien-3-D-glucopyranoside Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 576.37 C33H52O8
LMST03020670 1-Hydroxyvitamin D3 cellobioside (5Z,7E)-(1S,3R)-9,10-seco-5,7,10(19)-cholestatrien-3-cellobioside Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 724.44 C39H64O12
LMST03020656 1-Hydroxyvitamin D3 diacetate (5Z,7E)-(1S,3R)-9,10-seco-5,7,10(19)-cholestatrien-1,3-diethanoate Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 484.36 C31H48O4
LMST03020309 1-methyl-1,25-dihydroxy-4-nor-2,3-secovitamin D3 (5E,7E)-1-methyl-A-nor-(2,3)-(9,10)-diseco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 418.34 C27H46O3
LMST03020158 1-oxoprevitamin D3 (6Z)-(3R)-3-hydroxy-9,10-seco-5(10),6,8-cholestatriene-1-one Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 398.32 C27H42O2
LMST03020511 11-(3-acetoxy-1-propynyl)-1alpha,25-dihydroxy-9,11-didehydrovitamin D3 (5Z,7E)-(1S,3R)-11-(3-acetoxy-1-propynyl)-9,10-seco-5,7,9(11),10(19)-cholestatetraene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 510.33 C32H46O5
LMST03020539 11-(4-acetoxymethylphenyl)-1alpha,25-dihydroxy-9,11-didehydrovitamin D3 (5Z,7E)-(1S,3R)-11-(4-acetoxymethylphenyl)-9,10-seco-5,7,9(11),10(19)-cholestatetraene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 562.37 C36H50O5
LMST03020669 11-Hydroxyvitamin D3 (5Z,7E)-(3S,11S)-9,10-seco-5,7,10(19)-cholestatrien-3,11-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 400.33 C27H44O2
LMST03020538 11alpha-(4-dimethylaminophenyl)-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,3R,11S)-11-(4-dimethylaminophenyl)-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 535.4 C35H53NO3
LMST03020327 11alpha-(chloromethyl)-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,3R,11S)-11-(chloromethyl)-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 464.31 C28H45O3Cl
LMST03020329 11alpha-(fluoromethyl)-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,3R,11S)-11-(fluoromethyl)-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 448.34 C28H45O3F
LMST03020617 11alpha-Hemiglutaryloxy-1,25-dihydroxyvitamin D3 (5Z,7E)-(1S,3R,11R)-11-hemiglutaryloxy-9,10-seco-5,7,10(19)-cholestatrien-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 544.38 C33H52O6