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CHEBI:71494 - cis-trans-nepetalactol

ChEBI IDCHEBI:71494
ChEBI Namecis-trans-nepetalactol
Stars
ASCII Namecis-trans-nepetalactol
DefinitionA cyclopentapyran that is 1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran substituted at position 1 by a hydroxy group and at positions 4 and 7 by methyl groups (the 4aS,7S,7aR-diastereomer)
Last Modified27 August 2019
SubmitterKAX
DownloadsMolfile
FormulaC10H16O2
Net Charge0
Average Mass168.236
Monoisotopic Mass168.11503
SMILES[H][C@]12CC[C@H](C)[C@@]1([H])C(O)OC=C2C
InChIInChI=1S/C10H16O2/c1-6-3-4-8-7(2)5-12-10(11)9(6)8/h5-6,8-11H,3-4H2,1-2H3/t6-,8+,9+,10?/m0/s1
InChIKeyOJGPEAXUHQRLNC-CEPLBNANSA-N
ChEBI Ontology
Outgoing Relation(s)
cis-trans-nepetalactol (CHEBI:71494) is a cyclopentapyran (CHEBI:38606)
cis-trans-nepetalactol (CHEBI:71494) is a lactol (CHEBI:38131)
IUPAC Name 
(4aS,7S,7aR)-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-1-ol
Synonym  Source
(4aS,7S,7aR)-nepetalactolChEBI
UniProt Name  Source
cis-trans-nepetalactolUniProt
Registry NumbersSources
Reaxys:4860168Reaxys
Citations