1 |
Name | Rank | Metabolite Score | Similarity | MCS Score | Post-Mod Score | Post-Mod Info | Source | Link | Smiles | Molview | Full Name | Figure | |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
ebelactone | 0 | 0.73 | 0.56 | 0.79 | 1.0 | Non detected. | MIBiG | Source | CC[C@@H](C)[C@@H](O)[C@H](C)C(=O)[C@H](C)/C=C(\C)C[C@H](C)[C@@H]1OC(=O)[C@H]1C | view | ebelactone | ||
gibberellin A4 | 1 | 0.72 | 0.49 | 0.82 | 1.0 | Non detected. | MIBiG | Source | C=C1C[C@]23C[C@H]1CC[C@H]2[C@@]12CC[C@H](O)[C@@](C)(C(=O)O1)[C@H]2[C@@H]3C(=O)O | view | gibberellin A4 | ||
Kendomycin | 2 | 0.72 | 0.58 | 0.75 | 1.0 | Non detected. | MIBiG | Source | CC1=C2O[C@]3(O)C=C2C(=C(O)C1=O)[C@@H]1O[C@H](CC[C@H](C)/C=C(/C)C[C@@H](C)C[C@@H]3C)[C@H](C)[C@H](O)[C@H]1C | view | Kendomycin | ||
gibberellin A7 | 3 | 0.71 | 0.5 | 0.8 | 1.0 | Non detected. | MIBiG | Source | C=C1C[C@]23C[C@H]1CC[C@H]2[C@@]12C=C[C@H](O)[C@@](C)(C(=O)O1)[C@H]2[C@@H]3C(=O)O | view | gibberellin A7 | ||
herboxidiene | 4 | 0.71 | 0.55 | 0.76 | 1.0 | Non detected. | MIBiG | Source | CO[C@@H]([C@@H](C)O)[C@@H](C)[C@H]1O[C@]1(C)C[C@H](C)/C=C/C=C(\C)[C@H]1O[C@@H](CC(=O)O)CC[C@@H]1C | view | herboxidiene | ||
gibberellin A1 | 5 | 0.7 | 0.47 | 0.8 | 1.0 | Non detected. | MIBiG | Source | C=C1C[C@]23C[C@@]1(O)CC[C@H]2[C@@]12CC[C@H](O)[C@@](C)(C(=O)O1)[C@H]2[C@@H]3C(=O)O | view | gibberellin A1 | ||
gibberellin A3 | 6 | 0.7 | 0.49 | 0.79 | 1.0 | Non detected. | MIBiG | Source | C=C1C[C@]23C[C@@]1(O)CC[C@H]2[C@@]12C=C[C@H](O)[C@@](C)(C(=O)O1)[C@H]2[C@@H]3C(=O)O | view | gibberellin A3 | ||
viguiepinol | 7 | 0.7 | 0.5 | 0.77 | 1.0 | Non detected. | MIBiG | Source | C=C[C@@]1(C)CC=C2[C@@H](CC[C@@H]3C(C)(C)[C@@H](O)CC[C@@]23C)C1 | view | viguiepinol | ||
lycosantalonol | 8 | 0.7 | 0.52 | 0.75 | 1.0 | Non detected. | MIBiG | Source | CC(C)=CCCC(C)(O)C(=O)CC[C@]1(C)C2CC3C(C2)C31C | view | lycosantalonol | ||
betaenone A | 9 | 0.69 | 0.48 | 0.77 | 1.0 | Non detected. | MIBiG | Source | CCC(C)C1C2(C)C(=O)/C(=C\O)C(O)(C3CC(C)(O)CC(C)C32)C1(C)O | view | betaenone A | ||
Abyssomicin C | 10 | 0.69 | 0.5 | 0.75 | 1.0 | Non detected. | MIBiG | Source | C[C@@H]1C/C=C\[C@@H]2[C@@H](O)[C@@H]3OC4=C(C(=O)O[C@]42C[C@H]3C)C(=O)[C@H](C)C1 | view | Abyssomicin C | ||
E-837 | 11 | 0.69 | 0.56 | 0.71 | 1.0 | Non detected. | MIBiG | Source | C/C=C(\C)C(O)C(C)/C=C/C=C(\C)CCC(O)CC1=C(C)C(=O)C(C)(O)O1 | view | E-837 | ||
betaenone B | 12 | 0.68 | 0.49 | 0.75 | 1.0 | Non detected. | MIBiG | Source | CC[C@@H](C)[C@H]1[C@](C)(O)C(=O)[C@H]2C[C@](C)(O)C[C@@H](C)[C@@H]2[C@@]1(C)C(=O)CCO | view | betaenone B | ||
betaenone C | 13 | 0.68 | 0.49 | 0.74 | 1.0 | Non detected. | MIBiG | Source | CCC(C)C1C(C)(O)C(=O)C2CC(C)(O)CC(C)C2C1(C)C(=O)/C=C\O | view | betaenone C | ||
equisetin | 14 | 0.68 | 0.51 | 0.73 | 1.0 | Non detected. | MIBiG | Source | C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)/C(O)=C1/C(=O)[C@H](CO)N(C)C1=O | view | equisetin | ||
fusaridione A | 15 | 0.68 | 0.5 | 0.73 | 1.0 | Non detected. | MIBiG | Source | C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)C(=O)C1=C(O)N(C)[C@@H](CO)C1=O | view | fusaridione A | ||
phytocassane | 16 | 0.68 | 0.53 | 0.71 | 1.0 | Non detected. | MIBiG | Source | C=CC1=CC(=O)[C@H]2[C@@H](CC[C@H]3C(C)(C)C(=O)[C@@H](O)C[C@]23C)[C@H]1C | view | phytocassane | ||
Borrelidin | 17 | 0.67 | 0.5 | 0.72 | 1.0 | Non detected. | MIBiG | Source | C[C@@H]1C[C@H](C)[C@@H](O)CC(=O)O[C@H]([C@@H]2CCC[C@H]2C(=O)O)C/C=C\C=C(\C#N)[C@H](O)[C@@H](C)C[C@H](C)C1 | view | Borrelidin | ||
ambruticin | 18 | 0.66 | 0.5 | 0.7 | 1.0 | Non detected. | MIBiG | Source | CC[C@H]1O[C@@H](/C(C)=C/[C@H](C)/C=C/[C@@H]2[C@@H](/C=C/[C@@H]3O[C@H](CC(=O)O)C[C@H](O)[C@H]3O)[C@@H]2C)CC=C1C | view | ambruticin | ||
macrophorin A | 19 | 0.66 | 0.5 | 0.7 | 1.0 | Non detected. | MIBiG | Source | C=C1CCC2C(C)(C)CCCC2(C)C1CC12OC1C(O)C(CO)=CC2=O | view | macrophorin A | ||
4´-oxomacrophorin A | 20 | 0.66 | 0.49 | 0.7 | 1.0 | Non detected. | MIBiG | Source | C=C1CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1C[C@@]12O[C@@H]1C(=O)C(CO)=CC2=O | view | 4´-oxomacrophorin A | ||
E-492 | 21 | 0.66 | 0.51 | 0.68 | 1.0 | Non detected. | MIBiG | Source | C/C=C(\C)C(O)C(C)/C=C/C=C/CCC(O)CC1=C(C)C(=O)C(O)(C(C)O)O1 | view | E-492 | ||
lovastatin | 22 | 0.65 | 0.49 | 0.69 | 1.0 | Non detected. | MIBiG | Source | CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@H]21 | view | lovastatin | ||
(-)-delta-cadinene | 23 | 0.65 | 0.49 | 0.69 | 1.0 | Non detected. | MIBiG | Source | CC1=C[C@H]2C(=C(C)CC[C@@H]2C(C)C)CC1 | view | (-)-delta-cadinene | ||
myxalamid | 24 | 0.65 | 0.48 | 0.69 | 1.0 | Non detected. | MIBiG | Source | CC(/C=C/C=C\C=C\C=C(/C)C(=O)N[C@@H](C)CO)=C\[C@@H](C)[C@@H](O)/C(C)=C/C(C)C | view | myxalamid | ||
(+)-T-muurolol | 25 | 0.65 | 0.48 | 0.69 | 1.0 | Non detected. | MIBiG | Source | CC1=C[C@@H]2[C@@H](C(C)C)CC[C@@](C)(O)[C@@H]2CC1 | view | (+)-T-muurolol | ||
monacolin K | 26 | 0.65 | 0.48 | 0.69 | 1.0 | Non detected. | MIBiG | Source | CC(O)CC(=O)OC1CC(C)C=C2C=CC(C)C(CCC3CC(O)CC(=O)O3)C21 | view | monacolin K | ||
Thalianol | 27 | 0.65 | 0.48 | 0.69 | 1.0 | Non detected. | MIBiG | Source | CC(C)=CCC/C(C)=C/CC[C@@H](C)[C@@]1(C)CCC2=C1CC[C@H]1C(C)(C)[C@@H](O)CC[C@]21C | view | Thalianol | ||
E-975 | 28 | 0.65 | 0.51 | 0.67 | 1.0 | Non detected. | MIBiG | Source | CC/C=C(\C)C(O)C(C)/C=C/C=C/CCC(O)CC1=C(C)C(=O)C(O)(C(C)O)O1 | view | E-975 | ||
Aurafuron A | 29 | 0.64 | 0.52 | 0.65 | 1.0 | Non detected. | MIBiG | Source | CC1=C(CC(O)/C=C\C=C\C(C)C(O)/C(C)=C/CC(C)C)OC(C)(O)C1=O | view | Aurafuron A | ||
galbonolide A | 30 | 0.64 | 0.52 | 0.65 | 1.0 | Non detected. | MIBiG | Source | C=C1/C=C(/C)[C@H](CC)OC(=O)[C@H](C)C(=O)C(O)(CO)C/C(OC)=C\[C@@H](C)C1 | view | galbonolide A | ||
chaetoviridin | 31 | 0.63 | 0.47 | 0.65 | 1.0 | Non detected. | MIBiG | Source | CC[C@H](C)/C=C/C1=CC2=C(Cl)C(=O)[C@@]3(C)OC(=O)C(C(=O)[C@H](C)[C@@H](C)O)=C3C2=CO1 | view | chaetoviridin | ||
4´-oxomacrophorin E | 32 | 0.63 | 0.49 | 0.64 | 1.0 | Non detected. | MIBiG | Source | C=C1CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1C[C@@]12O[C@@H]1C(=O)C(COC(=O)CC(=O)O)=CC2=O | view | 4´-oxomacrophorin E | ||
Dorrigocin A | 33 | 0.61 | 0.49 | 0.61 | 1.0 | Non detected. | MIBiG | Source | CO[C@@H](/C=C/CC/C=C/C(=O)O)[C@@H](O)[C@H](C)/C=C(\C)[C@H](O)[C@H](C)C(=O)CCCC1CC(=O)NC(=O)C1 | view | Dorrigocin A | ||
13-epi-Dorrigocin A | 34 | 0.61 | 0.49 | 0.61 | 1.0 | Non detected. | MIBiG | Source | CO[C@@H](/C=C/CC/C=C/C(=O)O)[C@@H](O)[C@H](C)/C=C(\C)[C@@H](O)[C@H](C)C(=O)CCCC1CC(=O)NC(=O)C1 | view | 13-epi-Dorrigocin A | ||
cycloheximide | 35 | 0.61 | 0.48 | 0.61 | 1.0 | Non detected. | MIBiG | Source | C[C@H]1C[C@H](C)C(=O)[C@H]([C@H](O)CC2CC(=O)NC(=O)C2)C1 | view | cycloheximide | ||
copalyl diphosphate | 36 | 0.61 | 0.47 | 0.61 | 1.0 | Non detected. | MIBiG | Source | C=C1CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC/C(C)=C/COP(=O)(O)OP(=O)(O)O | view | copalyl diphosphate | ||
isobongkrekic acid | 37 | 0.6 | 0.47 | 0.6 | 1.0 | Non detected. | MIBiG | Source | CO[C@H](C/C=C\C=C\CC/C=C/C[C@H](C)/C=C/C(=C/C(=O)O)CC(=O)O)/C(C)=C\C=C(C)C | view | isobongkrekic acid | ||
methymycin | 38 | 0.6 | 0.47 | 0.59 | 1.0 | Non detected. | MIBiG | Source | CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@H](C)C[C@@H](C)C(=O)/C=C\[C@]1(C)O | view | methymycin | ||
Pellasoren | 39 | 0.6 | 0.47 | 0.59 | 1.0 | Non detected. | MIBiG | Source | CC/C=C(\OC)C(=O)N[C@@H](C)/C=C(C)/C=C(C)/C=C/C[C@H](C)[C@H]1OC(=O)[C@H](C)C[C@@H]1C | view | Pellasoren | ||
9-methylstreptimidone | 40 | 0.6 | 0.49 | 0.58 | 1.0 | Non detected. | MIBiG | Source | C/C=C\C(C)=C\[C@H](C)C(=O)C[C@H](O)CC1CC(=O)NC(=O)C1 | view | 9-methylstreptimidone | ||
Dorrigocin B | 41 | 0.59 | 0.49 | 0.57 | 1.0 | Non detected. | MIBiG | Source | CO[C@@H](/C=C/CC/C=C/C(=O)O)[C@@H](O)[C@H](C)[C@@H](O)/C(C)=C/[C@H](C)C(=O)CCCC1CC(=O)NC(=O)C1 | view | Dorrigocin B | ||
Kalimantacin A | 42 | 0.59 | 0.5 | 0.56 | 1.0 | Non detected. | MIBiG | Source | C=C(CCC=CC=CCC(C)CC(=O)CC(O)CNC(=O)C(C)C(C)OC(N)=O)CC(C)CC(C)=CC(=O)O | view | Kalimantacin A | ||
corallopyronin | 43 | 0.58 | 0.48 | 0.56 | 1.0 | Non detected. | MIBiG | Source | C/C=C/C/C=C(\C)C(O)CC/C(C)=C/C=C(C)/C(O)=C1/C(=O)C=C([C@H](C)CC/C=C/NC(=O)OC)OC1=O | view | corallopyronin | ||
tautomycetin | 44 | 0.58 | 0.48 | 0.56 | 1.0 | Non detected. | MIBiG | Source | C=C/C(=C/C(=O)CC(C)CC(C)CCC(O)C(C)C(=O)CC(O)C(C)C(C)OC(=O)CC(O)C1=C(C)C(=O)OC1=O)CC | view | tautomycetin | ||
tautomycetin | 45 | 0.58 | 0.48 | 0.56 | 1.0 | Non detected. | MIBiG | Source | C=C/C(=C/C(=O)C[C@H](C)C[C@@H](C)CC[C@H](O)[C@H](C)C(=O)C[C@@H](O)[C@H](C)[C@@H](C)OC(=O)C[C@@H](O)C1=C(C)C(=O)OC1=O)CC | view | tautomycetin | ||
yanuthone D | 46 | 0.58 | 0.49 | 0.55 | 1.0 | Non detected. | MIBiG | Source | CC(C)=CCC/C(C)=C/CC/C(C)=C/C[C@@]12O[C@@H]1C(=O)C(COC(=O)CC(C)(O)CC(=O)O)=CC2=O | view | yanuthone D | ||
coronatine | 47 | 0.56 | 0.5 | 0.5 | 1.0 | Non detected. | MIBiG | Source | CC[C@H]1C[C@@]1(NC(=O)C1=C[C@H](CC)C[C@@H]2C(=O)CC[C@H]12)C(=O)O | view | coronatine | ||
botcinic acid | 48 | 0.54 | 0.49 | 0.46 | 1.0 | Non detected. | MIBiG | Source | CCCC[C@H](O)/C=C/C(=O)O[C@H]1[C@H](C)O[C@](C)([C@@H](O)[C@@H](C)C(=O)O)[C@@H](O)[C@@H]1C | view | botcinic acid |