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CHEBI:67227 - β-carotene 15,15'-epoxide

ChEBI IDCHEBI:67227
ChEBI Nameβ-carotene 15,15'-epoxide
Stars
ASCII Namebeta-carotene 15,15'-epoxide
DefinitionAn epoxycarotenoid obtained by epoxidation across the 15,15'-double bond of β-carotene.
Last Modified30 August 2012
SubmitterKAX
DownloadsMolfile
FormulaC40H56O
Net Charge0
Average Mass552.887
Monoisotopic Mass552.43312
SMILESCC1=C(/C=C/C(C)=C/C=C/C(C)=C/C2OC2/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)CCCC2(C)C)C(C)(C)CCC1
InChIInChI=1S/C40H56O/c1-29(21-23-35-33(5)19-13-25-39(35,7)8)15-11-17-31(3)27-37-38(41-37)28-32(4)18-12-16-30(2)22-24-36-34(6)20-14-26-40(36,9)10/h11-12,15-18,21-24,27-28,37-38H,13-14,19-20,25-26H2,1-10H3/b17-11+,18-12+,23-21+,24-22+,29-15+,30-16+,31-27+,32-28+
InChIKeyAULCUSCIZQQSMU-WDJSDFAOSA-N
ChEBI Ontology
Outgoing Relation(s)
β-carotene 15,15'-epoxide (CHEBI:67227) is a epoxycarotenoid (CHEBI:23043)
IUPAC Name 
15,15'-dihydro-15,15'-epoxy-β,β-carotene
Synonyms  Source
15,15'-epoxy-15,15'-dihydro-β,β-caroteneChemIDplus
15,15'-epoxy-β,β-caroteneChemIDplus
15-EbbctChemIDplus
15,15'-epoxy-β-caroteneChEBI
UniProt Name  Source
β-carotene 15,15' epoxideUniProt
Manual XrefsDatabases
CPD-14386MetaCyc
Registry NumbersSources
Reaxys:5892331Reaxys
CAS:132541-62-9ChemIDplus