CHEBI:65776 - 4β,14-dihydroxy-6α,7β-H-1(10)-cadinene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4β,14-dihydroxy-6α,7β-H-1(10)-cadinene
ChEBI ID CHEBI:65776
ChEBI ASCII Name 4beta,14-dihydroxy-6alpha,7beta-H-1(10)-cadinene
Definition A cadinane sesquiterpenoid that is 1,2,3,4,6,7,8,8a-octahydronaphthalen-2-ol substituted by hydroxymethyl group at position 5, isopropyl group at position 8 and a methyl group at position 2 (the 2S,8R,8aR stereoisomer). Isolated from the culture broth of Tyromyces chioneus, it exhibits anti-HIV-1 activity.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C15H26O2
Net Charge 0
Average Mass 238.36570
Monoisotopic Mass 238.19328
InChI InChI=1S/C15H26O2/c1-10(2)12-5-4-11(9-16)13-6-7-15(3,17)8-14(12)13/h10,12,14,16-17H,4-9H2,1-3H3/t12-,14-,15+/m1/s1
InChIKey AEIGTUFAPRNEKB-YUELXQCFSA-N
SMILES [H][C@]12C[C@@](C)(O)CCC1=C(CO)CC[C@@H]2C(C)C
Metabolite of Species Details
Tyromyces chioneus (NCBI:txid83250) See: PubMed
Roles Classification
Biological Role(s): anti-HIV-1 agent
An anti-HIV agent that destroys or inhibits the replication of HIV-1, the more infective and more virulent of the two types of HIV virus.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 4β,14-dihydroxy-6α,7β-H-1(10)-cadinene (CHEBI:65776) has role anti-HIV-1 agent (CHEBI:64947)
4β,14-dihydroxy-6α,7β-H-1(10)-cadinene (CHEBI:65776) has role metabolite (CHEBI:25212)
4β,14-dihydroxy-6α,7β-H-1(10)-cadinene (CHEBI:65776) is a cadinane sesquiterpenoid (CHEBI:22975)
4β,14-dihydroxy-6α,7β-H-1(10)-cadinene (CHEBI:65776) is a carbobicyclic compound (CHEBI:36785)
4β,14-dihydroxy-6α,7β-H-1(10)-cadinene (CHEBI:65776) is a secondary alcohol (CHEBI:35681)
4β,14-dihydroxy-6α,7β-H-1(10)-cadinene (CHEBI:65776) is a tertiary alcohol (CHEBI:26878)
IUPAC Name
(2S,8R,8aR)-5-(hydroxymethyl)-2-methyl-8-(propan-2-yl)-1,2,3,4,6,7,8,8a-octahydronaphthalen-2-ol
Citation Waiting for Citations Type Source
17551214 PubMed citation Europe PMC
Last Modified
08 January 2013