CHEBI:156379 - paraherquonin

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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 paraherquonin
ChEBI ID CHEBI:156379
Definition Published in DOI:10.1016/S0040-4039(00)88109-5
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C24H28O7
Net Charge 0
Average Mass 428.481
Monoisotopic Mass 428.18350
InChI InChI=1S/C24H28O7/c1-10-12-7-16(25)31-21(3,4)13(12)8-15-23(6)14(10)9-22(5)19(26)30-20-24(22,27)18(23)17(29-15)11(2)28-20/h7-8,10-11,14-15,20,27H,9H2,1-6H3/t10-,11+,14+,15+,20-,22+,23-,24+/m1/s1
InChIKey DIPUOHVSHWSKHT-QUUCWOAOSA-N
SMILES [C@@]12([C@@]3(C=C4C([C@H]([C@@]1(C[C@@]5([C@@]6(C2=C([C@@H](O[C@@]6(OC5=O)[H])C)O3)O)C)[H])C)=CC(OC4(C)C)=O)[H])C
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via meroterpenoid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing paraherquonin (CHEBI:156379) is a cyclic terpene ketone (CHEBI:36130)
paraherquonin (CHEBI:156379) is a meroterpenoid (CHEBI:64419)
paraherquonin (CHEBI:156379) is a organic heteropolycyclic compound (CHEBI:38166)
paraherquonin (CHEBI:156379) is a terpene lactone (CHEBI:37668)
paraherquonin (CHEBI:156379) is a tertiary alcohol (CHEBI:26878)