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CHEBI:200199 - 16-deacetoxy-7beta-hydroxyfusidic acid
| Formula | C29H46O5 |
| Net Charge | 0 |
| Average Mass | 474.682 |
| Monoisotopic Mass | 474.33452 |
| SMILES | CC(C)=CCC/C(C(=O)O)=C1/CC[C@@]2(C)[C@H]1C[C@@H](O)[C@H]1[C@@]3(C)CC[C@@H](O)[C@@H](C)[C@@H]3C[C@H](O)[C@@]12C |
| InChI | InChI=1S/C29H46O5/c1-16(2)8-7-9-19(26(33)34)18-10-13-28(5)21(18)14-23(31)25-27(4)12-11-22(30)17(3)20(27)15-24(32)29(25,28)6/h8,17,20-25,30-32H,7,9-15H2,1-6H3,(H,33,34)/b19-18+/t17-,20-,21-,22+,23+,24-,25-,27-,28-,29-/m0/s1 |
| InChIKey | VYHHOMDLVBXTJZ-QUMOXZQVSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Trichothecium crotocinigenum (ncbitaxon:261922) | - | PubMed (16930645) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 16-deacetoxy-7beta-hydroxyfusidic acid (CHEBI:200199) is a 11-hydroxy steroid (CHEBI:36841) |
| IUPAC Name |
|---|
| (2E)-6-methyl-2-[(3R,4S,5S,7S,8S,9S,10S,11R,13S,14S)-3,7,11-trihydroxy-4,8,10,14-tetramethyl-2,3,4,5,6,7,9,11,12,13,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ylidene]hept-5-enoic acid |
| Manual Xrefs | Databases |
|---|---|
| 17250516 | ChemSpider |