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3-hydroxy-alpha-ionone

MNXM14565 is deprecated and here replaced by MNXM1368156
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1368156 Image of MNXM1368156
referencechebi:67266
formulaC13H20O2
global charge0
mol weight208.301
InChIKeyFDSNVAKZRJLMJN-AATRIKPKSA-N
InChIInChI=1S/C13H20O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h5-7,11-12,15H,8H2,1-4H3/b6-5+
SMILESCC(=O)/C=C/C1C(C)=CC(O)CC1(C)C
MNX internals
InChI (mnx)InChI=1/C13H20O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h5-7,11-12,15H,8H2,1-4H3/b6-5+/t11?,12? Image of MNXM1368156
SMILES (mnx)[CH3:1][C:9]1=[CH:7][CH:11]([OH:15])[CH2:8][C:13]([CH3:3])([CH3:4])[CH:12]1/[CH:6]=[CH:5]/[C:10]([CH3:2])=[O:14]
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:67266
chebi:67266
FDSNVAKZRJLMJN-AATRIKPKSA-N 		3-hydroxy-alpha-ionone
(3E)-4-(4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one