Feedback

all-trans-3,4-didehydroretinoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM40794

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	1

formula

C₂₀H₂₅O₂

charge

-1

mass

297.186

reference

InChIKey

SYESMXTWOAQFET-YCNIQYBTSA-M

InChI

InChI=1S/C20H26O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6-12,14H,13H2,1-5H3,(H,21,22)/p-1/b9-6+,12-11+,15-8+,16-14+

SMILES

CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C(=O)[O-])C(C)(C)CC=C1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:132260 chebi:132260	all-trans-3,4-didehydroretinoate 15-oxido-3,4-didehydroretinal all-trans-3,4-didehydroretinoate(1-)
lipidmaps:LMPR01090020 lipidmapsM:LMPR01090020	All-Trans-3,4-Didehydro-Retinoic acid
bigg.metabolite:CE2955 biggM:CE2955	All-trans-3,4-didehydroretinoate
hmdb:HMDB0060092	all-trans-3,4-Didehydroretinoate (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)nona-2,4,6,8-tetraenoic acid 3,4-Didehydroretinoate 3,4-Didehydroretinoic acid 3,4-Didehydroretinoic acid, sodium salt Didehydroretinoate Didehydroretinoic acid Vitamin a2 acid all-trans-3,4-Didehydro-retinoate all-trans-3,4-Didehydro-retinoic acid all-trans-3,4-Didehydroretinoic acid
CHEBI:133794 chebi:133794	all-trans-3,4-didehydroretinoic acid (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)nona-2,4,6,8-tetraenoic acid 3,4-didehydroretinoic acid 3-dehydroretinoic acid Ro 8-7057 all-trans-3,4-didehydro-retinoic acid didehydroretinoic acid vitamin A2 acid
hmdb:HMDB60092 biggM:M_CE2955	secondary/obsolete/fantasy identifier