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CHEBI:35309 - (5S,6R)-β-carotene 5,6-epoxide

ChEBI IDCHEBI:35309
ChEBI Name(5S,6R)-β-carotene 5,6-epoxide
Stars
ASCII Name(5S,6R)-beta-carotene 5,6-epoxide
Last Modified29 August 2006
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC40H56O
Net Charge0
Average Mass552.887
Monoisotopic Mass552.43312
SMILESCC1=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
InChIInChI=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
InChIKeyRVCRIPILOFSMFG-MLLMWRMGSA-N
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
(5S,6R)-β-carotene 5,6-epoxide (CHEBI:35309) is a β-carotene 5,6-epoxide (CHEBI:27793)
IUPAC Name 
(5S,6R)-5,6-epoxy-5,6-dihydro-β,β-carotene
Synonym  Source
(5S,6R)-β-carotene 5,6-epoxideChEBI
Registry NumbersSources
Beilstein:1443891Beilstein