CHEBI:217837 - Hyafurone A2

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 Hyafurone A2
ChEBI ID CHEBI:217837
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C32H44O6
Net Charge 0
Average Mass 524.698
Monoisotopic Mass 524.31379
InChI InChI=1S/C32H44O6/c1-22(13-11-14-23(2)30(35)24(3)18-19-26-15-7-6-8-16-26)12-9-10-17-27(33)20-28(34)21-29-25(4)31(36)32(5,37)38-29/h6-17,23-24,27-28,30,33-35,37H,18-21H2,1-5H3/b12-9+,14-11+,17-10+,22-13+
InChIKey NMMBWYBMSULADK-KZJHSZOWSA-N
SMILES O=C1C(=C(CC(O)CC(O)/C=C/C=C/C(=C/C=C/C(C(O)C(CCC2=CC=CC=C2)C)C)/C)OC1(O)C)C
Metabolite of Species Details
Hyalangium (NCBI:txid224455) See: PubMed
ChEBI Ontology
Outgoing Hyafurone A2 (CHEBI:217837) is a long-chain fatty alcohol (CHEBI:17135)
IUPAC Name
2-hydroxy-2,4-dimethyl-5-[(5E,7E,9E,11E)-2,4,14-trihydroxy-9,13,15-trimethyl-17-phenylheptadeca-5,7,9,11-tetraenyl]uran-3-one
Manual Xref Database
34217211 ChemSpider
View more database links