input word = C00008063

Metabolite InformationStructural formula
Name Ambofuracin
Formula C27H32O12
Mw 548.18937649
CAS RN 82358-50-7
C_ID C00008063 ,
InChIKey DFDBQOBSZWTRTL-CPWQZDMPNA-N
InChICode InChI=1S/C27H32O12/c1-34-21(30)9-10-22(31)36-13-20-23(32)24(33)26(27(35-2)38-20)39-25-17-8-7-16(29)12-18(17)37-19(25)11-14-3-5-15(28)6-4-14/h3-8,12,19-20,23-29,32-33H,9-11,13H2,1-2H3/t19-,20-,23+,24+,25+,26-,27+/m0/s1
SMILES COC(=O)CCC(=O)OC[C@@H]1O[C@@H](OC)C(O[C@H]2c3ccc(O)cc3O[C@@H]2Cc2ccc(O)cc2)C(O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeNeorautanenia amboensis Ref.
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