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retinol

PropertiesImage
MNX_IDMNXM729111 Image of MNXM729111
referencechebi:50211
formulaC20H30O
global charge0
mol weight286.459
InChIKeyFPIPGXGPPPQFEQ-UHFFFAOYSA-N
InChIInChI=1S/C20H30O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,21H,7,10,14-15H2,1-5H3
SMILESCC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CCO
MNX internals
InChI (mnx)InChI=1/C20H30O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,21H,7,10,14-15H2,1-5H3/b9-6?,12-11?,16-8?,17-13? Image of MNXM729111
SMILES (mnx)[CH3:1][C:16](=[CH:8][CH:6]=[CH:9][C:17]([CH3:2])=[CH:13][CH2:15][OH:21])[CH:11]=[CH:12][C:19]1=[C:18]([CH3:3])[CH2:10][CH2:7][CH2:14][C:20]1([CH3:4])[CH3:5]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)9
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:50211
chebi:50211
FPIPGXGPPPQFEQ-UHFFFAOYSA-N 		retinol
3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-ol
hmdb:HMDB0247586
FPIPGXGPPPQFEQ-UHFFFAOYSA-N 		9-cis retinol
3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-ol
alpha-sol

seed.compound:cpd28098
seedM:cpd28098
FPIPGXGPPPQFEQ-UHFFFAOYSA-N 		Retinols

sabiork.compound:5107
sabiorkM:5107
FPIPGXGPPPQFEQ-UHFFFAOYSA-N 		Retinol
Vitamin A
Vitamin A1
all-trans-Retinol

metacyc.compound:Retinols
metacycM:Retinols
FPIPGXGPPPQFEQ-UHFFFAOYSA-N 		a retinol
Vitamin A
Vitamin A1

chebi:15037
chebi:26538
seedM:M_cpd28098 		secondary/obsolete/fantasy identifier