Structure Database (LMSD)

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LMSD: Lipid classification search results

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Vitamin D3 and derivatives [ST0302]

LM_ID Common Name Systematic Name Species Shorthand Formula Mass
LMST03020612 25-Hydroxyvitamin D3-bromoacetate (5Z,7E)-(3S)-3-(2-bromo-acetoxy)-9,10-seco-5,7,10(19)-cholestatrien-25-ol C29H45O3Br 520.255206
LMST03020613 1alpha,25-Dihydroxy-21-(3-hydroxy-3-methylbutyl)vitamin D(3) (5Z,7E)-(1R,3S)-21-(3-hydroxy-3-methyl-butyl)-9,10-seco-5,7,10(19)-cholestatrien-1,3,25-triol C32H54O4 502.402210
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 C31H44O3S 496.301117
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 C24H42O3 378.313395
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 C25H41O4F 424.298888
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 C33H52O6 544.376390
LMST03020618 3-Deoxyvitamin D3 (5Z,7E)-9,10-seco-5,7,10(19)-cholestatriene C27H44 368.344300
LMST03020619 3-Deoxy-25-hydroxyvitamin D3 (5Z,7E)-9,10-seco-5,7,10(19)-cholestatrien-25-ol C27H44O 384.339215
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 C32H44O4F6 606.314378
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 C32H48O5 512.350175
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 C32H46O5 510.334525
LMST03020623 24a,24b-Dihomo-9,10-secocholesta-5,7,10(19),24a-tetraen-1alpha,3,25-triol (5Z,7E,24aE)-(1S,3R)-24a,24b-dihomo-9,10-seco-5,7,10(19),24a-cholestatrien-1,3,25-triol C29H44O3 440.329045
LMST03020624 25-Hydroxy[26,27-methyl]vitamin D3 3beta-(1,2-epoxypropyl)ether (5Z,7E)-25-hydroxy-9,10-seco-5,7,10(19)-cholestatrien 3R-(1,2-epoxy-propyl)ether C29H46O3 442.344695
LMST03020625 18-(3-Hydroxy-3-methylbutyl)-20-methyl-9,10-secopregna-5,7,10(19),20-tetraene-1,3-diol (5Z,7E)-(1S,3R)-18-(3-hydroxy-3-methyl-butyl)-20-methyl-9,10-seco-5,7,10(19),20-pregnatetraen-1,3-diol C27H42O3 414.313395
LMST03020626 1alpha,25-Dihydroxy-2alpha-(3-hydroxypropyl)vitamin D3 (5Z,7E)-(1S,2S,3R)-2-(3-hydroxy-propyl)-9,10-seco-5,7,10(19)-cholestatrien-1,3,25-triol C30H50O4 474.370910
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 C29H50O4 462.370910
LMST03020628 1alpha,25-Dihydroxy-2E-ethylidene-19-norvitamin D3 (2E,5E,7E)-(1R,3R)-2-ethylidene-19-nor-9,10-seco-5,7-cholestadien-1,3,25-triol C28H46O3 430.344695
LMST03020629 1alpha,25-Dihydroxy-2Z-ethylidene-19-norvitamin D3 (2Z,5E,7E)-(1R,3R)-2-ethylidene-19-nor-9,10-seco-5,7-cholestadien-1,3,25-triol C28H46O3 430.344695
LMST03020630 (20R)-24-Hydroxy-19-norgeminivitamin D3 (7E)-(1S,3R,20R)-20-(3R,4-dihydroxy-4-methy-propyl)-19-nor-9,10-seco-5,7-cholestadien-1,3,25-triol C31H54O5 506.397125
LMST03020631 (20R)-24-Hydroxygeminivitamin D3 (5Z,7E)-(1S,3R,20R)-20-(3R,4-dihydroxy-4-methy-propyl)-9,10-seco-5,7,10(19)-cholestatrien-1,3,25-triol C32H54O5 518.397125
LMST03020632 (20S)-24-Hydroxy-19-norgeminivitamin D3 (7E)-(1S,3R,20S)-20-(3R,4-dihydroxy-4-methy-propyl)-19-nor-9,10-seco-5,7-cholestadien-1,3,25-triol C31H54O5 506.397125
LMST03020633 (20S)-24-Hydroxygeminivitamin D3 (5Z,7E)-(1S,3R,20S)-20-(3R,4-dihydroxy-4-methy-propyl)-9,10-seco-5,7,10(19)-cholestatrien-1,3,25-triol C32H54O5 518.397125
LMST03020634 16-Glutaryloxy-1alpha,25-dihydroxyvitamin D3 (5Z,7E)-(1S,3R,16R)-16-glutaryloxy-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol C32H50O7 546.355655
LMST03020635 16-Glutaryloxy-1alpha,25-dihydroxy-20-epivitamin D3 (5Z,7E)-(1S,3R,16R,20S)-16-glutaryloxy-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol C32H50O7 546.355655
LMST03020636 20(17->12beta)-abeo-1alpha,25-dihydroxy-24-dihomo-21-norvitamin D3 (5Z,7E)-(1S,3R,12R)-21-nor-24a,24b-dihomo-9,10-seco-20(17->12beta)-abeo-5,7,10(19)-cholestatriene-1,3,25-triol C28H46O3 430.344695
LMST03020637 1-Fluoro-25-hydroxy-16-ene-23-yne-26,27-hexadeuterovitamin-D3 (5Z,7E,16Z)-(1S,3R)-1-fluoro-13-yne-26,26,26,27,27,27-hexadeutero-9,10-seco-5,7,10(19),16-cholestatetraen-3,25-diol C27H31D6FO2 418.315420
LMST03020638 1alpha,24-Dihydroxy-22-ene-24-cyclopropylvitamin D3 (5Z,7E,22E)-(1S,3R)-24-cyclopropyl-9,10-seco-5,7,10(19),22-cholestatetraene-1,3,24-triol C30H46O3 454.344695
LMST03020639 16-Dehydroepicalcitriol (5Z,7E,16Z)-(1S,3R)-9,10-seco-5,7,10(19),16-cholestatetraene-1,3,25-triol C27H42O3 414.313395
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 C30H42O3S 482.285467
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 C30H42O3S 482.285467
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 C30H46O3 454.344695
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 C30H44O3 452.329045
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 C30H44O3 452.329045
LMST03020645 19-Nor-14,20-bisepi-23-yne-1,25 dihydroxyvitamin D3 (7E)-(1R,3R,14R,20R)-23-yne-19-nor-9,10-seco-5,7-cholestadiene-1,3,25-triol C26H40O3 400.297745
LMST03020646 25-Hydroxy-3-epivitamin D3 (5Z,7E)-(3R)-9,10-seco-5,7,10(19)-cholestatriene-3,25-diol C27H44O2 400.334130
LMST03020647 24,24-Difluoro-1,25,26-trihydroxyvitamin D3 (7E)-(1R,3R)-24,24-difluoro-19-nor-9,10-seco-5,7-cholestadiene-1,3,25,26-tetrol C26H42O4F2 456.305116
LMST03020648 3-epi-vitamin D3 (5Z,7E)-(3R)-9,10-seco-5,7,10(19)-cholestatrien-3-ol C27H44O 384.339215
LMST03020649 19-Nor-14-epi-23-yne-1,25 dihydroxyvitamin D3 (7E)-(1R,3R,14R)-19-nor-23-yne-9,10-seco-5,7-cholestadiene-1,3,25-triol C26H40O3 400.297745
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 C23H36O2 344.271530
LMST03020651 1alpha,25-Dihydroxyvitamin D3 25-trimethylsilyl ether (5Z,7E)-(1S,3R)-9,10-seco-5,7,10(19)-cholestatrien-1,3-ol 25-trimethyl-silyl ether C30H52O3Si 488.368573
LMST03020652 Vitamin D3 sulfoconjugate (5Z,7E)-(3S)-9,10-seco-5,7,10(19)-cholestatrien-3-sulfonic acid C27H44O4S 464.296032
LMST03020653 Vitamin D3 palmitate (5Z,7E)-(3S)-9,10-seco-5,7,10(19)-cholestatriene-3-yl hexadecanoate C43H74O2 622.568880
LMST03020654 Vitamin D3 butyrate (5Z,7E)-(3S)-9,10-seco-5,7,10(19)-cholestatrien-3-butanoate C31H50O2 454.381080
LMST03020655 5,6-trans-25-Hydroxyvitamin D3 (5E,7Z)-(3S)-9,10-seco-5,7,10(19)-cholestatriene-3,25-diol C27H44O2 400.334130
LMST03020656 1-Hydroxyvitamin D3 diacetate (5Z,7E)-(1S,3R)-9,10-seco-5,7,10(19)-cholestatrien-1,3-diethanoate C31H48O4 484.355260
LMST03020657 1-Hydroxyprevitamin D3 (4E,6Z,8Z)-(1S,3R)-4-methyl-9,10-seco-4(5),6,8-cholestatrien-3-ol C27H44O2 400.334130
LMST03020658 3-Fluoro-9,10-secocholesta-5,7,10(19)-triene (5Z,7E)-(3S)-3-fluoro-9,10-seco-5,7,10(19)-cholestatriene C27H43F 386.334878
LMST03020659 1-Hydroxyprevitamin D3 diacetate (5E,6Z,8Z)-(1S,3R)-9,10-seco-5(10),6,8-cholestatrien-1,3-diethanoate C31H48O4 484.355260
LMST03020660 1alpha,25-Dihydroxy-previtamin D3 (4E,6Z,8Z)-(1S,3R)-4-methyl-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol C27H44O3 416.329045
LMST03020661 1alpha-Hydroxypregnacalciferol (5E,7Z)-(1S,3R)-9,10-seco-5,7,10(19)-cholestatriene-1,3-diol C27H44O2 400.334130