input word = C00054689

Metabolite InformationStructural formula
Name 5,8:5',8'-Diepoxy-5,5',8,8'-tetrahydro-beta,beta-carotene-3,3'-diol
Auroxanthin
Formula C40H56O4
Mw 600.41786028
CAS RN 27785-15-5
C_ID C00054689
InChIKey HDGIVZIDKGSQIG-WVQGXVFOSA-N
InChICode InChI=1S/C41H58O3/c1-28(18-14-20-31(4)34-22-36-38(6,7)24-30(3)25-40(36,10)43-34)16-12-13-17-29(2)19-15-21-32(5)35-23-37-39(8,9)26-33(42)27-41(37,11)44-35/h12-23,30,33-35,42H,24-27H2,1-11H3/b13-12+,18-14+,19-15+,28-16+,29-17+,31-20+,32-21+/t30-,33-,34?,35?,40+,41+/m0/s1
SMILES CC(/C=C/C=C(C)C1C=C2C(C)(C)C[C@H](C)C[C@@]2(C)O1)=CC=CC=C(C)C=CC=C(/C)C1C=C2C(C)(C)C[C@H](O)C[C@@]2(C)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
Plantae--Lonicera japonica Ref.
PlantaeAnacardiaceaeMangifera indica Ref.
PlantaeAsparagaceaeAsparagus officinalis Ref.
PlantaeFabaceaeDelonix regia Ref.
PlantaeFabaceaeMedicago sativa Ref.
PlantaeSolanaceaeCapsicum annuum Ref.
PlantaeViolaceaeViola tricolor Ref.
zoom in



OrganismViola tricolor
ReferenceKarrer, P. et al., Helv. Chim. Acta, 1944, 27, 1684

1945, 28, 427 (struct)