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CHEBI:207126 - Viridicatumone C

ChEBI IDCHEBI:207126
ChEBI NameViridicatumone C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H32O6
Net Charge0
Average Mass416.514
Monoisotopic Mass416.21989
SMILESC[C@H]1CC[C@H]2[C@@H](C=C[C@@](C)(O)[C@]2(C)C(=O)CCOC(=O)Cc2ccc(O)c(O)c2)C1
InChIInChI=1S/C24H32O6/c1-15-4-6-18-17(12-15)8-10-23(2,29)24(18,3)21(27)9-11-30-22(28)14-16-5-7-19(25)20(26)13-16/h5,7-8,10,13,15,17-18,25-26,29H,4,6,9,11-12,14H2,1-3H3/t15-,17-,18-,23+,24-/m0/s1
InChIKeyDIKUSSDEPBGHAT-IJTAQTPCSA-N
Species of MetaboliteComponentSourceComments
Penicillium viridicatum (ncbitaxon:60134) - PubMed (31790231)
ChEBI Ontology
Outgoing Relation(s)
Viridicatumone C (CHEBI:207126) is a catechols (CHEBI:33566)
IUPAC Name 
[3-[(1R,2R,4aR,6S,8aS)-2-hydroxy-1,2,6-trimethyl-4a,5,6,7,8,8a-hexahydronaphthalen-1-yl]-3-oxopropyl] 2-(3,4-dihydroxyphenyl)acetate