input word = C00006145

Metabolite InformationStructural formula
Name Orobol 8-C-(6''-acetylglucoside)
Formula C23H22O12
Mw 490.11112617
CAS RN 118949-93-2
C_ID C00006145 ,
InChIKey PPCJHDPUVJLYLC-BVEREPBDNA-N
InChICode InChI=1S/C23H22O12/c1-8(24)33-7-15-19(30)20(31)21(32)23(35-15)17-14(28)5-13(27)16-18(29)10(6-34-22(16)17)9-2-3-11(25)12(26)4-9/h2-6,15,19-21,23,25-28,30-32H,7H2,1H3/t15-,19+,20-,21+,23-/m0/s1
SMILES c1(cc(c2c(c1[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)COC(=O)C)O)O)O)occ(c2=O)c1ccc(c(c1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeDalbergia monetaria Ref.
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