input word = C00023145

Metabolite InformationStructural formula
Name 4,4'-Diapo-psi,psi-Carotenedioic acid mono-beta-D-glucopyranosyl ester
Formula C36H46O9
Mw 622.31418307
CAS RN 70240-67-4
C_ID C00023145 ,
InChIKey XAPKOWJMHPKSFE-BHBUMRHJNA-N
InChICode InChI=1S/C36H46O9/c1-24(15-9-17-26(3)19-11-21-28(5)34(41)42)13-7-8-14-25(2)16-10-18-27(4)20-12-22-29(6)35(43)45-36-33(40)32(39)31(38)30(23-37)44-36/h7-22,30-33,36-40H,23H2,1-6H3,(H,41,42)/b8-7+,15-9+,16-10+,19-11+,20-12+,24-13+,25-14+,26-17+,27-18+,28-21+,29-22+/t30-,31+,32-,33-,36-/m0/s1
SMILES C(=O)(/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=C(/C(=O)O)\C)\C)\C)/C)/C)/C)O[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaMethylobacteriaceaeMethylobacterium rhodinum Ref.
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