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Calamusenone

PropertiesImage
MNX_IDMNXM120032 Image of MNXM120032
referencechebi:138760
formulaC15H22O
global charge0
mol weight218.34
InChIKeyWJQUHMZHLUTNPJ-UHFFFAOYSA-N
InChIInChI=1S/C15H22O/c1-9(2)13-8-14-10(3)5-6-12(14)11(4)7-15(13)16/h10-11H,5-8H2,1-4H3
SMILESCC(C)=C1CC2=C(CCC2C)C(C)CC1=O
MNX internals
InChI (mnx)InChI=1/C15H22O/c1-9(2)13-8-14-10(3)5-6-12(14)11(4)7-15(13)16/h10-11H,5-8H2,1-4H3/t10?,11? Image of MNXM120032
SMILES (mnx)[CH3:1][C:9]([CH3:2])=[C:13]1[CH2:8][C:14]2=[C:12]([CH2:6][CH2:5][CH:10]2[CH3:3])[CH:11]([CH3:4])[CH2:7][C:15]1=[O:16]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:138760
chebi:138760
WJQUHMZHLUTNPJ-UHFFFAOYSA-N 		Calamusenone
7-isopropylidene-1,4-dimethyl-2,3,4,5,7,8-hexahydro-6(1H)-azulenone
hmdb:HMDB0038200
WJQUHMZHLUTNPJ-UHFFFAOYSA-N 		Calamusenone
1,4-dimethyl-7-(propan-2-ylidene)-1,2,3,4,5,6,7,8-octahydroazulen-6-one
1,4-dimethyl-7-(propan-2-ylidene)-1,2,3,4,5,8-hexahydroazulen-6-one

hmdb:HMDB38200 		secondary/obsolete/fantasy identifier