input word = C00016841

Metabolite InformationStructural formula
Name Bequinostatin B
Formula C27H24O7
Mw 460.15220312
CAS RN 151013-38-6
C_ID C00016841 ,
InChIKey UYRCIENQUKZJJU-UHFFFAOYNA-N
InChICode InChI=1S/C27H24O7/c1-2-3-4-5-12-6-13-8-19(30)22-15(21(13)18(29)7-12)11-17-24(26(22)33)27(34)23-16(25(17)32)9-14(28)10-20(23)31/h6-7,9-11,19,28-31,33H,2-5,8H2,1H3/t19-/m1/s1
SMILES c12c(C(=O)c3c(C1=O)cc1c(c3O)[C@@H](Cc3c1c(cc(c3)CCCCC)O)O)c(cc(c2)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. MI384-DF12 Ref.
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