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CHEBI:231482 - kihadalactone A

ChEBI IDCHEBI:231482
ChEBI Namekihadalactone A
Stars
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC30H40O7
Net Charge0
Average Mass512.643
Monoisotopic Mass512.27740
SMILES[H][C@]12CC[C@]3(C)C(=CC[C@@]3([H])c3ccoc3)[C@]1(C)[C@H](OC(C)=O)C[C@@]1([H])C(C)(C)OC(=O)C[C@H](OC(C)=O)[C@]21C
InChIInChI=1S/C30H40O7/c1-17(31)35-24-14-23-27(3,4)37-26(33)15-25(36-18(2)32)30(23,7)22-10-12-28(5)20(19-11-13-34-16-19)8-9-21(28)29(22,24)6/h9,11,13,16,20,22-25H,8,10,12,14-15H2,1-7H3/t20-,22-,23-,24+,25-,28-,29-,30+/m0/s1
InChIKeyONWYJKOVGIGNQN-IFRITVQJSA-N
ChEBI Ontology
Outgoing Relation(s)
kihadalactone A (CHEBI:231482) is a acetate ester (CHEBI:47622)
kihadalactone A (CHEBI:231482) is a organic heteropentacyclic compound (CHEBI:38164)
UniProt Name  Source
kihadalactone AUniProt
Citations