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10beta-12,13-dinor-8-oxo-6-eremophilen-11-al

PropertiesImage
MNX_IDMNXM116089 Image of MNXM116089
referencechebi:138757
formulaC13H18O2
global charge0
mol weight206.285
InChIKeyQJHOMNLQPDCBJF-UHFFFAOYSA-N
InChIInChI=1S/C13H18O2/c1-9-4-3-5-11-6-12(15)10(8-14)7-13(9,11)2/h7-9,11H,3-6H2,1-2H3
SMILESCC1CCCC2CC(=O)C(C=O)=CC12C
MNX internals
InChI (mnx)InChI=1/C13H18O2/c1-9-4-3-5-11-6-12(15)10(8-14)7-13(9,11)2/h7-9,11H,3-6H2,1-2H3/t9?,11?,13? Image of MNXM116089
SMILES (mnx)[CH3:1][CH:9]1[CH2:4][CH2:3][CH2:5][CH:11]2[CH2:6][C:12](=[O:15])[C:10]([CH:8]=[O:14])=[CH:7][C:13]12[CH3:2]
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:138757
chebi:138757
QJHOMNLQPDCBJF-UHFFFAOYSA-N 		10beta-12,13-dinor-8-oxo-6-eremophilen-11-al
8,8a-dimethyl-3-oxo-3,4,4a,5,6,7,8,8a-octahydro-2-naphthalenecarbaldehyde
hmdb:HMDB0037604
QJHOMNLQPDCBJF-UHFFFAOYSA-N 		10beta-12,13-Dinor-8-oxo-6-eremophilen-11-al
10b-12,13-Dinor-8-oxo-6-eremophilen-11-al
10beta-12,13-dinor-8-oxo-6-eremophilen-11-al
8,8a-dimethyl-3-oxo-3,4,4a,5,6,7,8,8a-octahydronaphthalene-2-carbaldehyde
8,8a-dimethyl-3-oxo-4,4a,5,6,7,8-hexahydronaphthalene-2-carbaldehyde

hmdb:HMDB37604 		secondary/obsolete/fantasy identifier