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all-trans-3,4-didehydroretinol

MNXM169417 is deprecated and here replaced by MNXM731526
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM731526

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	3

formula

C₂₀H₂₈O

charge

mass

284.21402

reference

InChIKey

XWCYDHJOKKGVHC-OVSJKPMPSA-N

InChI

InChI=1S/C20H28O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6-13,21H,14-15H2,1-5H3/b9-6+,12-11+,16-8+,17-13+

SMILES

CC1=C(/C=C/C(C)=C/C=C/C(C)=C/CO)C(C)(C)CC=C1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:132246 chebi:132246	all-trans-3,4-didehydroretinol (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)nona-2,4,6,8-tetraen-1-ol 3,4-didehydro-all-trans-retinol 3,4-didehydro-retinol 3,4-didehydroretinol 3-dehydoretinol all-trans-3-Dehydroretinol dehydroretinol vitamin A2
lipidmaps:LMPR01090008 lipidmapsM:LMPR01090008	All-Trans-3,4-Didehydro Retinol 3,4-didehydro-retinol
hmdb:HMDB0013117	Vitamin A2 (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)nona-2,4,6,8-tetraen-1-ol 3,4-Didehydro-all-trans-retinol 3,4-Didehydro-retinol 3,4-Didehydroretinol 3-Dehydoretinol 3-Dehydroretinol Dehydroretinol VA2 Vitamin a2 Vitamin a2, (7-cis)-isomer all-trans-3,4-Didehydro retinol all-trans-3,4-Didehydroretinol all-trans-3-Dehydroretinol vitamin A 2
bigg.metabolite:CE1162 biggM:CE1162	Vitamin A2 all-trans-3-dehydroretinol
kegg.compound:C21797 keggC:C21797	all-trans-3,4-Didehydroretinol Vitamin A2
metacyc.compound:CPD-20073 metacycM:CPD-20073 seed.compound:cpd35962 seedM:cpd35962	all-trans-3,4-didehydroretinol
hmdb:HMDB13117 biggM:M_CE1162 keggC:M_C21797 seedM:M_cpd35962	secondary/obsolete/fantasy identifier