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CHEBI:215151 - Spiroganocalitone B

Default Structure
ChEBI IDCHEBI:215151
ChEBI NameSpiroganocalitone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H42O7
Net Charge0
Average Mass514.659
Monoisotopic Mass514.29305
SMILESC[C@@H]1C[C@]2(C[C@H](C)C(=O)O2)O[C@@]12C[C@H](O)[C@@]1(C)C3=C(C(=O)C[C@]21C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1C[C@@H]3O
InChIInChI=1S/C30H42O7/c1-15-11-29(36-24(15)35)12-16(2)30(37-29)14-21(34)28(7)23-17(31)10-19-25(3,4)20(33)8-9-26(19,5)22(23)18(32)13-27(28,30)6/h15-17,19,21,31,34H,8-14H2,1-7H3/t15-,16+,17-,19-,21-,26-,27-,28-,29-,30-/m0/s1
InChIKeyCTBUPPQPICQVQX-XDXZQEKDSA-N
Species of MetaboliteComponentSourceComments
Ganoderma calidophilum (ncbitaxon:2026244) - PubMed (28800421)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
Spiroganocalitone B (CHEBI:215151) is a withanolide (CHEBI:74716)
Manual XrefsDatabases
78442367ChemSpider