CHEBI:91143 - (3S,5R,6S)-β-cryptoxanthin 5,6-epoxide

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ChEBI Name (3S,5R,6S)-β-cryptoxanthin 5,6-epoxide
ChEBI ID CHEBI:91143
ChEBI ASCII Name (3S,5R,6S)-beta-cryptoxanthin 5,6-epoxide
Definition An epoxycarotenol that β-cryptoxanthin in which the 5,6-double bond has been epoxidised.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Nevila Nouspikel
Supplier Information
Download Molfile XML SDF
Formula C40H56O2
Net Charge 0
Average Mass 568.873
Monoisotopic Mass 568.42803
InChI InChI=1S/C40H56O2/c1-30(18-13-20-32(3)23-24-36-34(5)22-15-26-37(36,6)7)16-11-12-17-31(2)19-14-21-33(4)25-27-40-38(8,9)28-35(41)29-39(40,10)42-40/h11-14,16-21,23-25,27,35,41H,15,22,26,28-29H2,1-10H3/b12-11+,18-13+,19-14+,24-23+,27-25+,30-16+,31-17+,32-20+,33-21+/t35-,39+,40-/m0/s1
InChIKey CMOLUFWHADIFGS-VESOQFFVSA-N
SMILES [C@]12([C@](C[C@H](CC1(C)C)O)(C)O2)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C3=C(CCCC3(C)C)C)\C)\C)/C)/C
Metabolite of Species Details
Pouteria sapota (NCBI:txid233744) See: PubMed
Carica papaya (NCBI:txid3649) See: IND20531516
Capsicum annuum var. annuum (NCBI:txid40321) See: PubMed
Capsicum annuum (NCBI:txid4072) See: PubMed
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (3S,5R,6S)-β-cryptoxanthin 5,6-epoxide (CHEBI:91143) has functional parent β-cryptoxanthin (CHEBI:10362)
(3S,5R,6S)-β-cryptoxanthin 5,6-epoxide (CHEBI:91143) has role plant metabolite (CHEBI:76924)
(3S,5R,6S)-β-cryptoxanthin 5,6-epoxide (CHEBI:91143) is a epoxycarotenol (CHEBI:35307)
IUPAC Name
(3S,5R,6S)-5,6-dihydro-5,6-epoxy-β,β-caroten-3-ol
Synonyms Sources
(5R,6S)-5,6-epoxi-β-cryptoxanthin UniProt
β-cryptoxanthin 5,6-epoxide ChEBI
cryptoxanthin-5,6-epoxide ChEBI
Registry Number Type Source
6757251 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
24065101 PubMed citation Europe PMC
26057604 PubMed citation Europe PMC
4465341 PubMed citation SUBMITTER
8910532 PubMed citation SUBMITTER
IND20531516 Agricola citation Europe PMC
IND92033257 Agricola citation Europe PMC
Last Modified
11 April 2016