input word = C00022900

Metabolite InformationStructural formula
Name Dihydroxylycopene diglucoside
1,1',2,2'-Tetrahydro-1,1'-bis(beta-D-glucopyranosyloxy)-psi,psi-carotene
Formula C52H80O12
Mw 896.56497802
CAS RN 345908-76-1
C_ID C00022900 ,
InChIKey ZJEXZWYLJSEOID-YSHCAUOCNA-N
InChICode InChI=1S/C52H80O12/c1-35(21-13-23-37(3)25-15-27-39(5)29-17-31-51(7,8)63-49-47(59)45(57)43(55)41(33-53)61-49)19-11-12-20-36(2)22-14-24-38(4)26-16-28-40(6)30-18-32-52(9,10)64-50-48(60)46(58)44(56)42(34-54)62-50/h11-16,19-28,41-50,53-60H,17-18,29-34H2,1-10H3/b12-11+,21-13+,22-14+,25-15+,26-16+,35-19+,36-20+,37-23+,38-24+,39-27+,40-28+/t41-,42+,43-,44-,45+,46+,47-,48-,49+,50+/m1/s1
SMILES C(=C\C=C(\CCCC(O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)(C)C)/C)/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=C(/CCCC(C)(O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C)\C)\C)\C)/C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaEctothiorhodospiraceaeHalorhodospira abdelmalekii Ref.
BacteriaEctothiorhodospiraceaeHalorhodospira halochloris Ref.
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OrganismHalorhodospira abdelmalekii
ReferenceTakaichi,Arch. Microbiol.,175,(2001),161