CHEBI:206203 - Aurovertin E

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Aurovertin E
ChEBI ID CHEBI:206203
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H30O7
Net Charge 0
Average Mass 418.486
Monoisotopic Mass 418.19915
InChI InChI=1S/C23H30O7/c1-6-18-22(3)21(26)23(4,30-18)20(25)16(29-22)12-10-8-7-9-11-15-14(2)17(27-5)13-19(24)28-15/h7-13,16,18,20-21,25-26H,6H2,1-5H3/t16-,18-,20-,21+,22-,23-/m0/s1
InChIKey ZPRKRBDMVCYLBR-XEANALEWSA-N
SMILES O=C1OC(=C(C)C(=C1)OC)C=CC=CC=C[C@@H]2O[C@@]3([C@@H](O)[C@]([C@H]2O)(O[C@H]3CC)C)C
Metabolite of Species Details
Albatrellopsis confluens (NCBI:txid2925186) See: PubMed
ChEBI Ontology
Outgoing Aurovertin E (CHEBI:206203) is a C-glycosyl compound (CHEBI:20857)
IUPAC Name
6-[6-[(1R,3S,4S,5S,7S,8S)-7-ethyl-4,8-dihydroxy-1,5-dimethyl-2,6-dioxabicyclo[3.2.1]octan-3-yl]hexa-1,3,5-trienyl]-4-methoxy-5-methylpyran-2-one