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4'-apo-beta-carotenal

Properties

Image

Occurences in reactions

MNX_ID

MNXM2485

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	1

formula

C₃₅H₄₆O

charge

mass

482.35487

reference

chebi:53157

InChIKey

FTQSFEZUHZHOAT-BRZOAGJPSA-N

InChI

InChI=1S/C35H46O/c1-28(17-11-19-30(3)20-13-22-32(5)27-36)15-9-10-16-29(2)18-12-21-31(4)24-25-34-33(6)23-14-26-35(34,7)8/h9-13,15-22,24-25,27H,14,23,26H2,1-8H3/b10-9+,17-11+,18-12+,20-13+,25-24+,28-15+,29-16+,30-19+,31-21+,32-22+

SMILES

CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C=C(\C)C=O)C(C)(C)CCC1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:53157 chebi:53157	4'-apo-beta-carotenal 4'-apo-beta,psi-caroten-4'-al 4'-apo-beta-caroten-4'-al beta-apo-4'-carotenal
seed.compound:cpd21132 seedM:cpd21132	4'-Apo-beta,psi-caroten-4'-al 4'-apo-beta,psi-caroten-4'-al 4'-apo-beta,psi-carotenal 4'-apo-beta-carotenal beta-Apo-4'-carotenal beta-apo-4'-carotenal
kegg.compound:C19892 keggC:C19892	4'-Apo-beta,psi-caroten-4'-al beta-Apo-4'-carotenal
metacyc.compound:CPD-12935 metacycM:CPD-12935	4'-apo-beta-carotenal 4'-apo-beta,psi-caroten-4'-al 4'-apo-beta,psi-carotenal beta-apo-4'-carotenal
keggC:M_C19892 seedM:M_cpd21132	secondary/obsolete/fantasy identifier