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CHEBI:215610 - Resinacein S
| Formula | C30H44O7 |
| Net Charge | 0 |
| Average Mass | 516.675 |
| Monoisotopic Mass | 516.30870 |
| SMILES | CC(C(=O)O)C(O)C(=O)C[C@@H](C)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)C1CC3 |
| InChI | InChI=1S/C30H44O7/c1-15(12-19(31)25(35)16(2)26(36)37)18-13-23(34)30(7)17-8-9-21-27(3,4)22(33)10-11-28(21,5)24(17)20(32)14-29(18,30)6/h15-16,18,21-22,25,33,35H,8-14H2,1-7H3,(H,36,37)/t15-,16?,18-,21?,22+,25?,28+,29-,30-/m1/s1 |
| InChIKey | FMNZGPOZCOZLMN-TVPRLHGPSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ganoderma resinaceum (ncbitaxon:34465) | - | PubMed (29490285) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Resinacein S (CHEBI:215610) is a triterpenoid (CHEBI:36615) |
| IUPAC Name |
|---|
| (6R)-3-hydroxy-6-[(3S,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-11,15-dioxo-2,3,5,6,7,12,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 78445653 | ChemSpider |