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Beta-Ionol

PropertiesImage
MNX_IDMNXM119737 Image of MNXM119737
referencechebi:191586
formulaC13H22O
global charge0
mol weight194.318
InChIKeyCNOPDZWOYFOHGN-BQYQJAHWSA-N
InChIInChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8,11,14H,5-6,9H2,1-4H3/b8-7+
SMILESCC1=C(/C=C/C(C)O)C(C)(C)CCC1
MNX internals
InChI (mnx)InChI=1/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8,11,14H,5-6,9H2,1-4H3/b8-7+/t11? Image of MNXM119737
SMILES (mnx)[CH3:1][C:10]1=[C:12](/[CH:8]=[CH:7]/[CH:11]([CH3:2])[OH:14])[C:13]([CH3:3])([CH3:4])[CH2:9][CH2:5][CH2:6]1
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:191586
chebi:191586
CNOPDZWOYFOHGN-BQYQJAHWSA-N 		Beta-Ionol
(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-ol
hmdb:HMDB0036820
CNOPDZWOYFOHGN-BQYQJAHWSA-N 		beta-Ionol
(3E)-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-ol
2-Hydroxy-beta-ionone
4-(2,6,6-Trimethyl-1-cyclohexen-1-yl)-3-buten-2-ol
4-(2,6,6-Trimethyl-1-cyclohexenyl)-3-buten-2-ol
4-(2,6,6-Trimethyl-1-cyclohexenyl)-but-3-en-2-ol
b-Ionol
beta-ionol

hmdb:HMDB36820 		secondary/obsolete/fantasy identifier