input word = C00031776

Metabolite InformationStructural formula
Name Erythroxyloside B
(-)-Erythroxyloside B
Formula C21H30O13
Mw 490.16864105
CAS RN 862885-01-6
C_ID C00031776 ,
InChIKey NRXBTQRAGXSHQT-LJJKPHBQNA-N
InChICode InChI=1S/C21H30O13/c1-7(22)13-10(23)4-9(5-11(13)30-3)33-21-19(29)17(27)15(25)12(34-21)6-31-20-18(28)16(26)14(24)8(2)32-20/h4-5,8,12,14-21,23-29H,6H2,1-3H3/t8-,12+,14-,15+,16+,17-,18+,19+,20+,21+/m0/s1
SMILES COc1cc(O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c1C(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeErythroxylaceaeErythroxylum cambodianum Ref.
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