Structure Database (LMSD)

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LMSD: Lipid classification search results

Withanolides and derivatives [ST0116]

LM_ID Common Name Systematic Name Species Shorthand Formula Mass
LMST01160000 Withanolide skeleton
LMST01160001 15beta-Hydroxynicandrin B 1-oxo-5alpha,12alpha,15beta-trihydroxy-6alpha,7alpha-epoxy-witha-2,24-dienolide ST 28:6;O7 C28H38O7 486.261755
LMST01160002 Minabeolide-1 3-oxo-witha-1,4,24-trienolide ST 28:6;O3 C28H38O3 422.282095
LMST01160003 Minabeolide-2 3-oxo-18-acetoxywitha-1,4,24-trienolide ST 29:7;O5 C29H38O5 466.271925
LMST01160004 Minabeolide-3 3-oxo-witha-4,24-dienolide ST 28:5;O3 C28H40O3 424.297745
LMST01160005 Minabeolide-4 28-nor-3-oxo-witha-1,4-dienolide ST 27:5;O3 C27H38O3 410.282095
LMST01160006 Minabeolide-5 28-nor-3-oxo-18-acetoxy-witha-1,4-dienolide ST 28:6;O5 C28H38O5 454.271925
LMST01160007 Minabeolide-6 28-nor-3-oxo-with-4-enolide ST 27:4;O3 C27H40O3 412.297745
LMST01160008 Minabeolide-7 28-nor-3-oxo-18-acetoxy-with-4-enolide ST 28:5;O5 C28H40O5 456.287575
LMST01160009 Minabeolide-8 28-nor-3-oxo-11alpha-acetoxy-with-4-enolide ST 29:5;O5 C29H42O5 470.303225
LMST01160010 4beta-Hydroxywithanolide E 15-[1-(4,5-dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl)-1-hydroxyethyl]-6,12,15-trihydroxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.0^{2,7}.0^{7,9}.0^{12,16}]octadec-4-en-3-one ST 28:6;O8 C28H38O8 502.256670
LMST01160011 Ixocarpalactone A (1S,2R,6S,7R,9R,11S,12S,14S,15R,16S)-15-[(1R,2R)-1-[(2R,3R,4R)-3,4-Dimethyl-5-oxooxolan-2-yl]-1,2-dihydroxypropan-2-yl]-6,14-dihydroxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.02,7.07,9.012,16]octadec-4-en-3-one ST 28:5;O8 C28H40O8 504.272320
LMST01160012 Physalolactone 17S,20S,22R-6alpha-chloro-4beta,5beta,17beta,14alpha,20alpha-pentahydroxy-1-oxo-ergosta-2,24-dienolide C28H39O8Cl 538.233348
LMST01160013 Physalolactone B (20R,22R)-1alpha-acetoxy-3?,20-dihydroxy-witha 5,24-dienolide ST 30:5;O6 C30H44O6 500.313790
LMST01160014 Physalolactone C 17S,20S,22R-6alpha-chloro-4beta,5beta,17beta,20alpha-tetrahydroxy-1-oxo-ergosta-2,14,24-trienolide C28H37O7Cl 520.222783
LMST01160015 Physapubenolide (20S,22R)-15alpha-acetoxy-5beta,6beta-epoxy-4beta,14beta-dihydroxy-1-oxo-witha- 2,24-dienolide ST 30:7;O8 C30H40O8 528.272320
LMST01160016 Taccalonolide A (2R,3R,5S)-2-(1-hydroxy-1-methyl-ethyl)-5-[(3R,5R,9R,10R,13S,14S,17S)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]tetrahydropyran-3-ol C36H46O14 702.288760
LMST01160017 Withaferin A 5beta,6beta:22R,26-diepoxyergosta-4beta,27-dihydroxy-2,24-diene-1,26-dione ST 28:6;O6 C28H38O6 470.266840
LMST01160018 Withanolide (1S,2R,6S,9R,11S,12S,15S,16S)-15-[(1R)-1-[(2R)-4,5-dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]-1-hydroxyethyl]-6-hydroxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.0^{2,7}.0^{7,9}.0^{12,16}]octadec-4-en-3-one ST 28:6;O6 C28H38O6 470.266840
LMST01160019 Withanolide A 15-[1-(4,5-dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl)-1-hydroxyethyl]-5-hydroxy-10,14-dimethyl-3-oxapentacyclo[9.7.0.0^{2,4}.0^{5,10}.0^{14,18}]octadec-7-en-9-one ST 28:6;O6 C28H38O6 470.266840
LMST01160020 Withanolide D (3aS,5aR,9bR)-5a,9-dimethyl-3-methylene-4,5,6,7,8,9b-hexahydro-3aH-benzo[g]benzofuran-2-one ST 28:6;O6 C28H38O6 470.266840
LMST01160021 Withaperuvin B 17S,20S,22R-4beta,5beta,6alpha,17beta,20alpha-pentahydroxy-1-oxo-ergosta-2,14,24-trienolide ST 28:6;O8 C28H38O8 502.256670
LMST01160022 Exodeconolide E 16alpha-acetoxy-7alpha-hydroxy-24,25-epoxy-1-oxowitha-2,5-dien-26,22-olide ST 30:7;O7 C30H40O7 512.277405
LMST01160023 Exodeconolide F 14,15-dihydroxy-1-oxowitha-2,5,24-trien-26,22-olide ST 28:6;O5 C28H38O5 454.271925
LMST01160024 Exodeconolide D 16alpha-acetoxy-7alpha-hydroxy-22,26:24,25-diepoxy-26-hydroxyergost-2,5-dien-1-one ST 30:6;O7 C30H42O7 514.293055
LMST01160025 (20S,22R)-3a,6a-epoxy-4beta,5beta,27-trihydroxy-1-oxowitha-24-enolide FA 28:8;O5 C28H40O7 488.277405
LMST01160026 Withanoside VIII 27-O-beta-D-glucopyranosylpubesenolide 3-O-beta-D-glucopyranosyl (1-6)-beta-D-glucopyranoside C46H72O20 944.461700
LMST01160027 Withanoside IX 27-O-beta-D-glucopyranosyl (1-6)-beta-D-glucopyranosylpubesenolide 3-O-beta-D-glucopyranosyl (1-6)-beta-D-glucopyranoside C52H82O25 1106.514525
LMST01160028 Withanoside X 27-O-beta-D-glucopyranosylpubesenolide 3-O-beta-D-glucopyranoside C40H62O15 782.408875
LMST01160029 Withanoside XI (20R,22R)-1alpha,3beta,20,27-tetrahydroxywitha-5,24-dienolide 3-O-beta-D-glucopyranoside C34H52O11 636.350965
LMST01160030 Zenkersterone (24R,25R)-6-oxo-2beta,3beta,14alpha 20R-tetrahydroxy-witha-7-enolide ST 28:4;O8 C28H42O8 506.287970
LMST01160031 Acutifolactone (22R,24S,25S)-5alpha-hydroxy-7alpha,8alpha;24alpha,25alpha-diepoxy-1,12,16-trioxowitha-2,17(20)-dienolide ST 28:9;O8 C28H32O8 496.209720
LMST01160032 Withaperuvin 17S,20S,22R-4beta,5beta,6alpha,14alpha,17beta,20alpha-hexahydroxy-1-oxo-ergosta-2,24-dienolide ST 28:5;O9 C28H40O9 520.267235
LMST01160033 Withaperuvin C 17S,20S,22R-6beta,14alpha,17beta,20alpha-tetrahydroxy-1-oxo-ergosta-2,4,24-trienolide ST 28:6;O7 C28H38O7 486.261755
LMST01160034 Paraminabeolide A (22R)-3,26-Dioxo-22,26-epoxyergosta-1,4,24-trien-18-al ST 28:6;O3 C28H36O4 436.261360
LMST01160035 Taccalonolide B C34H44O13 660.278195
LMST01160036 Nicansteroidin A 15alpha-acetoxy-5beta,6beta-epoxy-14beta,17beta,24beta-trihydroxy-1-oxo-witha-2,25(27)-dien-26,22-olide ST 30:7;O9 C30H40O9 544.267235
LMST01160037 Nicansteroidin B 15alpha-acetoxy-5beta,6beta-epoxy-14beta,17beta,24alpha-trihydroxy-1-oxo-witha-2,25(27)-dien-26,22-olide ST 30:7;O9 C30H40O9 544.267235
LMST01160038 Nicansteroidin C 15alpha-acetoxy-6beta,14beta-dihydroxy-1-oxo-2alpha,5alpha-dioxy-witha3,16,24-trien-26,22-olide ST 30:8;O9 C30H38O9 542.251585
LMST01160039 Nicansteroidin D 15alpha-acetoxy-16beta,17beta-epoxy-6beta,14beta-dihydroxy-1-oxo-2alpha,5alpha-dioxy-witha3,24-dien-26,22-olide ST 30:8;O10 C30H38O10 558.246500
LMST01160040 Physagulide I 15alpha-acetoxy-5beta,6beta-epoxy-14beta,17beta-dihydroxy-1-oxo-witha2,24-dien-26,22-olide ST 30:7;O8 C30H40O8 528.272320
LMST01160041 Physagulin K 15alpha-acetoxy-5alpha,6beta,14beta,17beta-tetrahydroxy-1-oxo-witha2,24-dien-26,22-olide ST 30:6;O9 C30H42O9 546.282885
LMST01160042 Physagulin A 15alpha-acetoxy-5beta,6beta-epoxy-14beta-hydroxy-1-oxo-witha2,16,24-trien-26,22-olide ST 30:8;O7 C30H38O7 510.261755
LMST01160043 Withaminimin 15alpha-acetoxy-5alpha,6beta,14alpha-trihydroxy-1-oxo-witha2,16,24-trien-26,22-olide ST 30:7;O8 C30H40O8 528.272320
LMST01160044 Physagulin B 15alpha-acetoxy-5alpha-chloro-6beta,14alpha-dihydroxy-1-oxo-witha2,16,24-trien-26,22-olide C30H39O7Cl 546.238433
LMST01160045 Physagulin A 15alpha-acetoxy-5beta,6beta-epoxy,14alpha-hydroxy-1-oxo-witha2,16,24-trien-26,22-olide ST 30:8;O7 C30H38O7 510.261755
LMST01160046 Physagulin D 1alpha,3beta,27-trihydroxywitha-5,24-dienolide 3-O-beta-D-glucopyranoside ST 28:4;O6;Hex C34H52O11 636.350965
LMST01160047 Physagulin J 15alpha-acetoxy-5alpha,6beta,14beta,trihydroxy-1-oxo-witha2,24-dien-26,22-olide ST 30:6;O8 C30H42O8 530.287970
LMST01160048 15alpha-acetoxy-5alpha-chloro-6beta,14beta,dihydroxy-1-oxo-witha2,24-dien-26,22-olide C30H41O7Cl 548.254083
LMST01160049 Physagulin C 15alpha-acetoxy-16beta,17beta-epoxy-5alpha-6beta,14beta,trihydroxy-1-oxo-witha2,24-dien-26,22-olide ST 30:7;O9 C30H40O9 544.267235