input word = C00023055

Metabolite InformationStructural formula
Name (2R,3S)-2,3-Dihydroxy-beta,beta-carotene-4,4'-dione
Formula C40H52O4
Mw 596.38656015
CAS RN 72826-79-0
C_ID C00023055 ,
InChIKey LGXSSQZQYOIWOB-NCGMYXEZNA-N
InChICode InChI=1S/C40H52O4/c1-27(17-13-19-29(3)21-23-33-31(5)35(41)25-26-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)36(42)37(43)38(44)40(34,9)10/h11-24,37-38,43-44H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+/t37-,38+/m1/s1
SMILES C1(=C(C(=O)[C@H]([C@@H](C1(C)C)O)O)C)/C=C/C(=C/C=C\C(=C\C=C\C=C(\C=C\C=C(\C=C\C1=C(C(=O)CCC1(C)C)C)/C)/C)\C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaRhizobiaceaeRhizobium lupini Ref.
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