Structure Database (LMSD)

LM_ID Common Name Systematic Name Main class Sub class Mass Formula
LMST03020132 (25R)-26,26,26-trifluoro-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,3R,25R)-26,26,26-trifluoro-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 470.3 C27H41O3F3
LMST03020068 (25S)-1alpha,25,26-trihydroxy-22-oxavitamin D3 (5Z,7E)-(1S,3R,25S)-22-oxa-9,10-seco-5,7,10(19)-cholestatriene-1,3,25,26-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 434.3 C26H42O5
LMST03020296 (25S)-1alpha,25,26-trihydroxyvitamin D3 (5Z,7E)-(1S,3R,25S)-9,10-seco-5,7,10(19)-cholestatriene-1,3,25,26-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 432.32 C27H44O4
LMST03020276 (25S)-25,26-dihydroxyvitamin D3 (5Z,7E)-(3S,25S)-9,10-seco-5,7,10(19)-cholestatriene-3,25,26-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 416.33 C27H44O3
LMST03020133 (25S)-26,26,26-trifluoro-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,3R,25S)-26,26,26-trifluoro-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 470.3 C27H41O3F3
LMST03020017 (5E)-(22R)-22-hydroxy-24,25,26,27-tetranorvitamin D3 (5E,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
LMST03020018 (5E)-(22S)-22-hydroxy-24,25,26,27-tetranorvitamin D3 (5E,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
LMST03020295 (5E)-(25R)-1alpha,25,26-trihydroxyvitamin D3 (5E,7E)-(1S,3R,25R)-9,10-seco-5,7,10(19)-cholestatriene-1,3,25,26-tetrol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 432.32 C27H44O4
LMST03020050 (5E)-(3S)-1alpha,25-dihydroxy-3-deoxy-3-thiavitamin D3 3-oxide (5E,7E)-(1R,3S)-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
LMST03020265 (5E)-1alpha,25-dihydroxyvitamin D3 (5E,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
LMST03020234 (5E)-1alpha-hydroxy-3-epivitamin D3 (5E,7E)-(1S,3S)-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 400.33 C27H44O2
LMST03020233 (5E)-1alpha-hydroxyvitamin D3 (5E,7E)-(1S,3R)-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 400.33 C27H44O2
LMST03020238 (5E)-1beta-hydroxy-3-epivitamin D3 (5E,7E)-(1R,3S)-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 400.33 C27H44O2
LMST03020237 (5E)-1beta-hydroxyvitamin D3 (5E,7E)-(1R,3R)-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 400.33 C27H44O2
LMST03020221 (5E)-3-epivitamin D3 (5E,7E)-(3R)-9,10-seco-5,7,10(19)-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 384.34 C27H44O
LMST03020225 (5E)-isovitamin D3 (5E,7E)-(3S)-9,10-seco-1(10),5,7-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 384.34 C27H44O
LMST03020220 (5E)-vitamin D3 (5E,7E)-(3S)-9,10-seco-5,7,10(19)-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 384.34 C27H44O
LMST03020494 (5E,10E)-19-(3-carboxylpropyl)vitamin D3 (5E,7E,10E)-(3S)-19-(3-carboxylpropyl)-9,10-seco-5,7,10(19)-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 470.38 C31H50O3
LMST03020215 (5E,10E)-19-fluoro-1alpha,25-dihydroxyvitamin D3 (5E,7E,10E)-(1S,3R)-19-fluoro-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 434.32 C27H43O3F
LMST03020206 (5E,10E)-19-fluoro-1alpha-hydroxyvitamin-D3 (5E,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
LMST03020201 (5E,10E)-19-fluorovitamin D3 (5E,7E,10E)-(3S)-19-fluoro-9,10-seco-5,7,10(19)-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 402.33 C27H43OF
LMST03020335 (5E,10E)-19-methylvitamin D3 (5E,7E,10E)-(3S)-19-methyl-9,10-seco-5,7,10(19)-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 398.35 C28H46O
LMST03020214 (5E,10Z)-19-fluoro-1alpha,25-dihydroxyvitamin D3 (5E,7E,10Z)-(1S,3R)-19-fluoro-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 434.32 C27H43O3F
LMST03020205 (5E,10Z)-19-fluoro-1alpha-hydroxyvitamin-D3 (5E,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
LMST03020200 (5E,10Z)-19-fluorovitamin D3 (5E,7E,10Z)-(3S)-19-fluoro-9,10-seco-5,7,10(19)-cholestatrien-3-ol Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 402.33 C27H43OF
LMST03020052 (5Z)-(3S)-1alpha,25-dihydroxy-3-deoxy-3-thiavitamin D3 3-oxide (5Z,7E)-(1R,3S)-1,25-dihydroxy-9,10-seco-3-thia-5,7,10(19)-cholestatrien 3-oxide Secosteroids [ST03] Vitamin D3 and derivatives [ST0302] 434.29 C26H42O3S
LMST03020043 (5Z)-1,25-dihydroxy-3-thiavitamin D3 (5Z,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
LMST03020051 (5Z)-1alpha,25-dihydroxy-3-deoxy-3-thiavitamin D3 3-oxide (5Z,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
LMST03020143 (5Z)-4,4-difluoro-1alpha,25-dihydroxyvitamin D3 (5Z,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
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