input word = C00016869

Metabolite InformationStructural formula
Name Bequinostatin C
Formula C28H22O8
Mw 486.13146768
CAS RN 152175-74-1
C_ID C00016869 ,
InChIKey NJGDHHRUAFIFFQ-UHFFFAOYSA-N
InChICode InChI=1S/C28H22O8/c1-2-3-4-5-12-8-13-6-7-15-16(20(13)26(33)21(12)28(35)36)11-18-23(25(15)32)27(34)22-17(24(18)31)9-14(29)10-19(22)30/h6-11,29-30,32-33H,2-5H2,1H3,(H,35,36)
SMILES CCCCCc1cc2ccc3c(O)c4c(cc3c2c(O)c1C(=O)O)C(=O)c1cc(O)cc(O)c1C4=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. MI384-DF12 Ref.
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