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all-trans-beta-carotene

Properties

Image

Occurences in reactions

MNX_ID

MNXM736699

	#reac
in my sandbox	0
in MNXref (generic)	70
in models (compartimentalized)	15

formula

C₄₀H₅₆

charge

mass

536.4382

reference

chebi:17579

InChIKey

OENHQHLEOONYIE-JLTXGRSLSA-N

InChI

InChI=1S/C40H56/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-39(37,7)8)17-11-12-18-32(2)20-14-22-34(4)26-28-38-36(6)24-16-30-40(38,9)10/h11-14,17-22,25-28H,15-16,23-24,29-30H2,1-10H3/b12-11+,19-13+,20-14+,27-25+,28-26+,31-17+,32-18+,33-21+,34-22+

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/C2=C(C)CCCC2(C)C)C(C)(C)CCC1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-5164389 reactomeM:R-ALL-5164389 reactome:R-ALL-975643 reactomeM:R-ALL-975643 CHEBI:17579 chebi:17579	all-trans-beta-carotene 1,1'-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaene-1,18-diyl]bis(2,6,6-trimethylcyclohexene) BETA-CAROTENE beta,beta-carotene beta-Carotene beta-Karotin beta-carotene
bigg.metabolite:caro biggM:caro	Beta-Carotene
lipidmaps:LMPR01070001 lipidmapsM:LMPR01070001	Beta-carotene
SLM:000000432 slm:000000432	all-trans-beta-carotene
kegg.drug:D03101 keggD:D03101	beta Carotene (USP) Betacarotene (INN) Solatene (TN)
sabiork.compound:5998 sabiorkM:5998	beta-Carotene
kegg.compound:C02094 keggC:C02094	beta-Carotene all-trans-beta-Carotene
seed.compound:cpd01420 seedM:cpd01420	beta-Carotene all-trans-beta-Carotene all-trans-beta-carotene beta,beta-carotene beta-carotene
metacyc.compound:CPD1F-129 metacycM:CPD1F-129	beta-carotene all-trans-beta-carotene beta,beta-carotene
chebi:10355 chebi:12392 chebi:22834 chebi:40987 biggM:M_caro keggC:M_C02094 keggD:M_D03101 seedM:M_cpd01420	secondary/obsolete/fantasy identifier