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CHEBI:212907 - Anandin A

ChEBI IDCHEBI:212907
ChEBI NameAnandin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H35NO2
Net Charge0
Average Mass357.538
Monoisotopic Mass357.26678
SMILESCC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2C3=CC(=O)N(CCO)C3=CC[C@]12C
InChIInChI=1S/C23H35NO2/c1-15(2)16(3)6-7-17(4)19-8-9-20-18-14-22(26)24(12-13-25)21(18)10-11-23(19,20)5/h6-7,10,14-17,19-20,25H,8-9,11-13H2,1-5H3/b7-6+/t16-,17+,19+,20-,23+/m0/s1
InChIKeyBSTAVZCXPLMHKH-GSDKABSXSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (29125577)
ChEBI Ontology
Outgoing Relation(s)
Anandin A (CHEBI:212907) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(5aR,6R,8aR)-6-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-3-(2-hydroxyethyl)-5a-methyl-6,7,8,8a-tetrahydro-5H-cyclopenta[e]indol-2-one
Manual XrefsDatabases
62816301ChemSpider