input word = C00022874

Metabolite InformationStructural formula
Name (2,3-trans)-beta,psi-Carotene-2,3-diol
Formula C40H56O2
Mw 568.42803103
CAS RN 69003-03-8
C_ID C00022874 ,
InChIKey BPCKQDCXXYKQHY-APUCIYKZNA-N
InChICode InChI=1S/C40H56O2/c1-30(2)17-13-20-33(5)23-15-25-34(6)24-14-21-31(3)18-11-12-19-32(4)22-16-26-35(7)27-28-37-36(8)29-38(41)39(42)40(37,9)10/h11-12,14-19,21-28,38-39,41-42H,13,20,29H2,1-10H3/b12-11+,21-14+,22-16+,25-15+,28-27+,31-18+,32-19+,33-23+,34-24+,35-26+/t38-,39+/m1/s1
SMILES [C@@H]1([C@@H](CC(=C(C1(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=C(/CCC=C(C)C)\C)\C)\C)/C)/C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaRhizobiaceaeRhizobium lupini Ref.
zoom in