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CHEBI:216107 - Talaroconvolutin C

ChEBI IDCHEBI:216107
ChEBI NameTalaroconvolutin C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC34H49NO5
Net Charge0
Average Mass551.768
Monoisotopic Mass551.36107
SMILESCCOC1C(C(=O)[C@H]2[C@@H](/C(C)=C/C(C)CC)C(C)=C[C@@]3(C)C[C@@H](C)CC[C@H]23)C(=O)NC1(O)Cc1ccc(O)cc1
InChIInChI=1S/C34H49NO5/c1-8-20(3)16-22(5)27-23(6)18-33(7)17-21(4)10-15-26(33)28(27)30(37)29-31(40-9-2)34(39,35-32(29)38)19-24-11-13-25(36)14-12-24/h11-14,16,18,20-21,26-29,31,36,39H,8-10,15,17,19H2,1-7H3,(H,35,38)/b22-16+/t20?,21-,26+,27-,28+,29?,31?,33+,34?/m0/s1
InChIKeySDUCDGMAWSHYSB-CITNPMNLSA-N
Species of MetaboliteComponentSourceComments
Talaromyces convolutus (ncbitaxon:1131474) - PubMed (10869198)
ChEBI Ontology
Outgoing Relation(s)
Talaroconvolutin C (CHEBI:216107) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
3-[(1R,2S,4aS,6S,8aR)-3,4a,6-trimethyl-2-[(E)-4-methylhex-2-en-2-yl]-2,5,6,7,8,8a-hexahydro-1H-naphthalene-1-carbonyl]-4-ethoxy-5-hydroxy-5-[(4-hydroxyphenyl)methyl]pyrrolidin-2-one
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