Structure Database (LMSD)
LMSD: Lipid classification search results
Sterol Lipids [ST] (W) --> Sterols [ST01]--> Withanolides and derivatives [ST0116]| LM_ID | Common Name | Systematic Name | Species Shorthand | Formula | Mass |
|---|---|---|---|---|---|
| LMST01160000 | Withanolide skeleton | - | - | - | - |
| LMST01160001 | 15β-Hydroxynicandrin B | 1-oxo-5α,12α,15β-trihydroxy-6α,7α- epoxy-witha-2,24-dienolide | ST 28:6;O7 | C28H38O7 | 486.2618 |
| LMST01160002 | Minabeolide-1 | 3-oxo-witha-1,4,24-trienolide | ST 28:6;O3 | C28H38O3 | 422.2821 |
| LMST01160003 | Minabeolide-2 | 3-oxo-18-acetoxywitha-1,4,24-trienolide | ST 29:7;O5 | C29H38O5 | 466.2719 |
| LMST01160004 | Minabeolide-3 | 3-oxo-witha-4,24-dienolide | ST 28:5;O3 | C28H40O3 | 424.2977 |
| LMST01160005 | Minabeolide-4 | 28-nor-3-oxo-witha-1,4-dienolide | ST 27:5;O3 | C27H38O3 | 410.2821 |
| LMST01160006 | Minabeolide-5 | 28-nor-3-oxo-18-acetoxy-witha-1,4- dienolide | ST 28:6;O5 | C28H38O5 | 454.2719 |
| LMST01160007 | Minabeolide-6 | 28-nor-3-oxo-with-4-enolide | ST 27:4;O3 | C27H40O3 | 412.2977 |
| LMST01160008 | Minabeolide-7 | 28-nor-3-oxo-18-acetoxy-with-4-enolide | ST 28:5;O5 | C28H40O5 | 456.2876 |
| LMST01160009 | Minabeolide-8 | 28-nor-3-oxo-11α-acetoxy-with-4-enolide | ST 29:5;O5 | C29H42O5 | 470.3032 |
| LMST01160010 | 4β-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[9.7.0.0ω{2,7}.0ω{7, 9}.0ω{12,16}]octadec-4-en-3-one | ST 28:6;O8 | C28H38O8 | 502.2567 |
| 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 | 504.2723 |
| LMST01160012 | Physalolactone | 17S,20S,22R-6α-chloro-4β,5β,17β,14α, 20α-pentahydroxy-1-oxo-ergosta-2,24- dienolide | - | C28H39O8Cl | 538.2333 |
| LMST01160013 | Physalolactone B | (20R,22R)-1α-acetoxy-3?,20-dihydroxy- witha 5,24-dienolide | ST 30:5;O6 | C30H44O6 | 500.3138 |
| LMST01160014 | Physalolactone C | 17S,20S,22R-6α-chloro-4β,5β,17β,20α- tetrahydroxy-1-oxo-ergosta-2,14,24- trienolide | - | C28H37O7Cl | 520.2228 |
| LMST01160015 | Physapubenolide | (20S,22R)-15α-acetoxy-5β,6β-epoxy- 4β,14β-dihydroxy-1-oxo-witha- 2,24- dienolide | ST 30:7;O8 | C30H40O8 | 528.2723 |
| 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 | 702.2888 |
| LMST01160017 | Withaferin A | 2,3,3-trimethyl-2H-benzo[g]benzofuran- 4,5-dione | ST 28:6;O6 | C28H38O6 | 470.2668 |
| 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[9.7.0.0ω{2,7}.0ω{7, 9}.0ω{12,16}]octadec-4-en-3-one | ST 28:6;O6 | C28H38O6 | 470.2668 |
| 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[9.7.0.0ω{2,4}.0ω{5, 10}.0ω{14,18}]octadec-7-en-9-one | ST 28:6;O6 | C28H38O6 | 470.2668 |
| 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 | 470.2668 |
| LMST01160021 | Withaperuvin B | 17S,20S,22R-4β,5β,6α,17β,20α- pentahydroxy-1-oxo-ergosta-2,14,24- trienolide | ST 28:6;O8 | C28H38O8 | 502.2567 |
| LMST01160022 | Exodeconolide E | 16α-acetoxy-7α-hydroxy-24,25-epoxy-1- oxowitha-2,5-dien-26,22-olide | ST 30:7;O7 | C30H40O7 | 512.2774 |
| LMST01160023 | Exodeconolide F | 14,15-dihydroxy-1-oxowitha-2,5,24- trien-26,22-olide | ST 28:6;O5 | C28H38O5 | 454.2719 |
| LMST01160024 | Exodeconolide D | 16α-acetoxy-7α-hydroxy-22,26:24,25- diepoxy-26-hydroxyergost-2,5-dien-1-one | ST 30:6;O7 | C30H42O7 | 514.2931 |
| LMST01160025 | - | (20S,22R)-3a,6a-epoxy-4β,5β,27- trihydroxy-1-oxowitha-24-enolide | FA 28:8;O5 | C28H40O7 | 488.2774 |
| LMST01160026 | Withanoside VIII | 27-O-β-D-glucopyranosylpubesenolide 3- O-β-D-glucopyranosyl (1-6)-β-D- glucopyranoside | - | C46H72O20 | 944.4617 |
| LMST01160027 | Withanoside IX | 27-O-β-D-glucopyranosyl (1-6)-β-D- glucopyranosylpubesenolide 3-O-β-D- glucopyranosyl (1-6)-β-D- glucopyranoside | - | C52H82O25 | 1106.5145 |
| LMST01160028 | Withanoside X | 27-O-β-D-glucopyranosylpubesenolide 3- O-β-D-glucopyranoside | - | C40H62O15 | 782.4089 |
| LMST01160029 | Withanoside XI | (20R,22R)-1α,3β,20,27- tetrahydroxywitha-5,24-dienolide 3-O- β-D-glucopyranoside | - | C34H52O11 | 636.3510 |
| LMST01160030 | Zenkersterone | (24R,25R)-6-oxo-2β,3β,14α 20R- tetrahydroxy-witha-7-enolide | ST 28:4;O8 | C28H42O8 | 506.2880 |
| LMST01160031 | Acutifolactone | (22R,24S,25S)-5α-hydroxy-7α,8α;24α,25α- diepoxy-1,12,16-trioxowitha-2,17(20)- dienolide | ST 28:9;O8 | C28H32O8 | 496.2097 |
| LMST01160032 | Withaperuvin | 17S,20S,22R-4β,5β,6α,14α,17β,20α- hexahydroxy-1-oxo-ergosta-2,24- dienolide | ST 28:5;O9 | C28H40O9 | 520.2672 |
| LMST01160033 | Withaperuvin C | 17S,20S,22R-6β,14α,17β,20α- tetrahydroxy-1-oxo-ergosta-2,4,24- trienolide | ST 28:6;O7 | C28H38O7 | 486.2618 |
| LMST01160034 | Paraminabeolide A | (22R)-3,26-Dioxo-22,26-epoxyergosta-1, 4,24-trien-18-al | ST 28:6;O3 | C28H36O4 | 436.2614 |
| LMST01160035 | Taccalonolide B | - | - | C34H44O13 | 660.2782 |
| LMST01160036 | Nicansteroidin A | 15α-acetoxy-5β,6β-epoxy-14β,17β, 24β-trihydroxy-1-oxo-witha-2,25(27)- dien-26,22-olide | ST 30:7;O9 | C30H40O9 | 544.2672 |
| LMST01160037 | Nicansteroidin B | 15α-acetoxy-5β,6β-epoxy-14β,17β, 24α-trihydroxy-1-oxo-witha-2,25(27)- dien-26,22-olide | ST 30:7;O9 | C30H40O9 | 544.2672 |
| LMST01160038 | Nicansteroidin C | 15α-acetoxy-6β,14β-dihydroxy-1-oxo- 2α,5α-dioxy-witha3,16,24-trien-26,22- olide | ST 30:8;O9 | C30H38O9 | 542.2516 |
| LMST01160039 | Nicansteroidin D | 15α-acetoxy-16β,17β-epoxy-6β,14β- dihydroxy-1-oxo-2α,5α-dioxy-witha3,24- dien-26,22-olide | ST 30:8;O10 | C30H38O10 | 558.2465 |
| LMST01160040 | Physagulide I | 15α-acetoxy-5β,6β-epoxy-14β,17β- dihydroxy-1-oxo-witha2,24-dien-26,22- olide | ST 30:7;O8 | C30H40O8 | 528.2723 |
| LMST01160041 | Physagulin K | 15α-acetoxy-5α,6β,14β,17β- tetrahydroxy-1-oxo-witha2,24-dien-26, 22-olide | ST 30:6;O9 | C30H42O9 | 546.2829 |
| LMST01160042 | Physagulin A | 15α-acetoxy-5β,6β-epoxy-14β-hydroxy- 1-oxo-witha2,16,24-trien-26,22-olide | ST 30:8;O7 | C30H38O7 | 510.2618 |
| LMST01160043 | Withaminimin | 15α-acetoxy-5α,6β,14α-trihydroxy-1- oxo-witha2,16,24-trien-26,22-olide | ST 30:7;O8 | C30H40O8 | 528.2723 |
| LMST01160044 | Physagulin B | 15α-acetoxy-5α-chloro-6β,14α- dihydroxy-1-oxo-witha2,16,24-trien-26, 22-olide | - | C30H39O7Cl | 546.2384 |
| LMST01160045 | Physagulin A | 15α-acetoxy-5β,6β-epoxy,14α-hydroxy- 1-oxo-witha2,16,24-trien-26,22-olide | ST 30:8;O7 | C30H38O7 | 510.2618 |
| LMST01160046 | Physagulin D | 1α,3β,27-trihydroxywitha-5,24- dienolide 3-O-β-D-glucopyranoside | ST 28:4;O6;Hex | C34H52O11 | 636.3510 |
| LMST01160047 | Physagulin J | 15α-acetoxy-5α,6β,14β,trihydroxy-1- oxo-witha2,24-dien-26,22-olide | ST 30:6;O8 | C30H42O8 | 530.2880 |
| LMST01160048 | - | 15α-acetoxy-5α-chloro-6β,14β, dihydroxy-1-oxo-witha2,24-dien-26,22- olide | - | C30H41O7Cl | 548.2541 |
| LMST01160049 | Physagulin C | 15α-acetoxy-16β,17β-epoxy-5α-6β, 14β,trihydroxy-1-oxo-witha2,24-dien- 26,22-olide | ST 30:7;O9 | C30H40O9 | 544.2672 |