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(5S,6R)-beta-carotene 5,6-epoxide

Properties

Image

Occurences in reactions

MNX_ID

MNXM31305

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

formula

C₄₀H₅₆O

charge

mass

552.43312

reference

chebi:35309

InChIKey

RVCRIPILOFSMFG-MLLMWRMGSA-N

InChI

InChI=1S/C40H56O/c1-31(19-13-21-33(3)24-25-36-35(5)23-15-27-37(36,6)7)17-11-12-18-32(2)20-14-22-34(4)26-30-40-38(8,9)28-16-29-39(40,10)41-40/h11-14,17-22,24-26,30H,15-16,23,27-29H2,1-10H3/b12-11+,19-13+,20-14+,25-24+,30-26+,31-17+,32-18+,33-21+,34-22+/t39-,40+/m0/s1

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@]23O[C@@]2(C)CCCC3(C)C)C(C)(C)CCC1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:35309 chebi:35309	(5S,6R)-beta-carotene 5,6-epoxide (5S,6R)-5,6-epoxy-5,6-dihydro-beta,beta-carotene
lipidmaps:LMPR01070292 lipidmapsM:LMPR01070292	(5S,6R)-beta-carotene 5,6-epoxide (5S,6R)-beta-carotene 5,6-epoxide 5S,6R-epoxy-5,6-dihydro-beta,beta-carotene
lipidmaps:LMPR01070267 lipidmapsM:LMPR01070267	beta-Carotene 5,6-epoxide
seed.compound:cpd05494 seedM:cpd05494 kegg.compound:C08587 keggC:C08587	beta-Carotene 5,6-epoxide 5,6-Epoxy-beta,beta-carotene
CHEBI:27793 chebi:27793	beta-carotene 5,6-epoxide 5,6-epoxy-5,6-dihydro-beta,beta-carotene 5,6-epoxy-beta,beta-carotene beta-Carotene 5,6-epoxide
chebi:10356 chebi:22835 keggC:M_C08587 seedM:M_cpd05494	secondary/obsolete/fantasy identifier