input word = C00023146

Metabolite InformationStructural formula
Name 4,4'-Diapo-psi,psi-carotenedioic acid di-beta-D-glucopyranosyl ester
Formula C42H56O14
Mw 784.3670065
CAS RN 70240-66-3
C_ID C00023146 ,
InChIKey ZVGZSPSYISRPRS-JBGJUAIXNA-N
InChICode InChI=1S/C42H56O14/c1-25(15-9-17-27(3)19-11-21-29(5)39(51)55-41-37(49)35(47)33(45)31(23-43)53-41)13-7-8-14-26(2)16-10-18-28(4)20-12-22-30(6)40(52)56-42-38(50)36(48)34(46)32(24-44)54-42/h7-22,31-38,41-50H,23-24H2,1-6H3/b8-7+,15-9+,16-10+,19-11+,20-12+,25-13+,26-14+,27-17+,28-18+,29-21+,30-22+/t31-,32-,33-,34-,35+,36+,37-,38-,41+,42+/m1/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@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)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
BacteriaAcetobacteraceaeRoseococcus thiosulfatophilus Ref.
BacteriaMethylobacteriaceaeMethylobacterium rhodinum Ref.
zoom in