CHEBI:223035 - (1R,3aR,6aS,7S,7aS)-3a,5,5,7a-tetramethyl-1,2,3,6,6a,7-hexahydrocyclopenta[a]pentalene-1,7-diol

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 (1R,3aR,6aS,7S,7aS)-3a,5,5,7a-tetramethyl-1,2,3,6,6a,7-hexahydrocyclopenta[a]pentalene-1,7-diol
ChEBI ID CHEBI:223035
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H24O2
Net Charge 0
Average Mass 236.355
Monoisotopic Mass 236.17763
InChI InChI=1S/C15H24O2/c1-13(2)7-9-10(8-13)14(3)6-5-11(16)15(14,4)12(9)17/h8-9,11-12,16-17H,5-7H2,1-4H3/t9-,11+,12-,14+,15-/m0/s1
InChIKey RCYZLITTYILPNL-FASAMLHVSA-N
SMILES O[C@@H]1[C@]2([C@@](CC[C@H]2O)(C)C=3[C@@H]1CC(C)(C)C3)C
Metabolite of Species Details
Cerrena albocinnamomea (NCBI:txid2169404) See: PubMed
ChEBI Ontology
Outgoing (1R,3aR,6aS,7S,7aS)-3a,5,5,7a-tetramethyl-1,2,3,6,6a,7-hexahydrocyclopenta[a]pentalene-1,7-diol (CHEBI:223035) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name
(1R,3aR,6aS,7S,7aS)-3a,5,5,7a-tetramethyl-1,2,3,6,6a,7-hexahydrocyclopenta[a]pentalene-1,7-diol
Manual Xref Database
78441202 ChemSpider
View more database links