input word = C00003767

Metabolite InformationStructural formula
Name beta-Carotene 5,6-epoxide
5,6-epoxy-beta-Carotene
Formula C40H56O
Mw 552.43311641
CAS RN 1923-89-3
C_ID C00003767 ,
InChIKey RVCRIPILOFSMFG-WWSVUWEKNA-N
InChICode 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-/m1/s1
SMILES [C@@]12(/C=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(CCC[C@@]1(C)O2)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnacardiaceaeMangifera indica Ref.
PlantaeAsteraceaeTussilago farfara Ref.
PlantaeCaricaceaeCarica papaya Ref.
PlantaeFabaceaeMedicago spp. Ref.
PlantaeOleaceaeForsythia spp. Ref.
PlantaeRosaceaeMalus spp. Ref.
PlantaeRutaceaeCitrus sinensis Ref.
PlantaeSolanaceaeCapsicum annuum Ref.
PlantaeSolanaceaeCyphomandra betacea Ref.
PlantaeSolanaceaeSolanum lycopersicum Ref.
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OrganismForsythia spp.
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter60