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9-cis-retinoate

Properties

Image

Occurences in reactions

MNX_ID

MNXM1107684

	#reac
in my sandbox	0
in MNXref (generic)	10
in models (compartimentalized)	10

formula

C₂₀H₂₇O₂

charge

-1

mass

299.20165

reference

chebi:78630

InChIKey

SHGAZHPCJJPHSC-ZVCIMWCZSA-M

InChI

InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(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)CCC1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:78630 chebi:78630	9-cis-retinoate (2E,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoate (9cis)-15-oxidoretinal
sabiork.compound:23496 sabiorkM:23496 kegg.compound:C15493 keggC:C15493	9-cis-Retinoic acid
hmdb:HMDB0002369	9-cis-Retinoic acid (2E,4E,6Z,8E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoate (2E,4E,6Z,8E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid (2E,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid (7E,9Z,11E,13E)-Retinoate (7E,9Z,11E,13E)-Retinoic acid 15-Apo-beta-caroten-15-Oate 15-Apo-beta-caroten-15-Oic acid 9 cis Retinoic acid 9(Z)-Retinoate 9(Z)-Retinoic acid 9-Retinoate 9-Retinoic acid 9-cis-Retinoate 9-cis-Tretinoin 9CRA compound Aberel Aberela Airol Aknoten Alitretinoin Alitretinoina Alitretinoine Alitretinoinum Atragen Avita Avitoin Dermairol Effederm Epi-aberel Eudyna Isotretinoin retinoate Isotretinoin retinoic acid Panretin Panretin gel Panretyn Panrexin Renova Retacnyl Retin a Retin-a Retin-a micro Retinoate Retinoic acid Retinova Toctino Tretinoin Tretinoin/all-trans retinoate Tretinoin/all-trans retinoic acid Tretinon Vesanoid Vesnaroid alitretinoin all-trans- Vitamin a1 acid all-trans-Vitamin a acid all-trans-b-Retinoate all-trans-b-Retinoic acid all-trans-beta-Retinoate all-trans-beta-Retinoic acid alpha-Vitaminsyre b-Retinoate b-Retinoic acid beta-Retinoate beta-Retinoic acid trans-Retinoate trans-Retinoic acid trans-Vitamin a acid
bigg.metabolite:CE1617 biggM:CE1617	9-cis-retinoate
reactome:R-ALL-5246470 reactomeM:R-ALL-5246470 reactome:R-ALL-5362520 reactomeM:R-ALL-5362520 CHEBI:50648 chebi:50648	9-cis-retinoic acid (2E,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid (7E,9Z,11E,13E)-retinoic acid (9cis)-retinoic acid 9(Z)-Retinoic acid 9-cis-Tretinoin Alitretinoin Panretin alitretinoina alitretinoine alitretinoinum
lipidmaps:LMPR01090022 lipidmapsM:LMPR01090022	9-cis-retinoic acid Alitretinoin
kegg.drug:D02815 keggD:D02815	Alitretinoin (USAN) Panretin (TN)
hmdb:HMDB02369 chebi:63793 biggM:M_CE1617 keggC:M_C15493 keggD:M_D02815	secondary/obsolete/fantasy identifier