input word = C00008062

Metabolite InformationStructural formula
Name Neoraufuracin
Formula C22H26O9
Mw 434.15768243
CAS RN 82358-46-1
C_ID C00008062 ,
InChIKey NYWDXRKGBVXINM-CXWZYEMONA-N
InChICode InChI=1S/C22H26O9/c1-28-22-21(19(27)18(26)17(10-23)30-22)31-20-14-7-6-13(25)9-15(14)29-16(20)8-11-2-4-12(24)5-3-11/h2-7,9,16-27H,8,10H2,1H3/t16-,17-,18-,19+,20-,21+,22+/m0/s1
SMILES CO[C@@H]1O[C@@H](CO)[C@@H](O)C(O)C1O[C@H]1c2ccc(O)cc2O[C@@H]1Cc1ccc(O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeNeorautanenia amboensis Ref.
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