input word = C00014904

Metabolite InformationStructural formula
Name IB 00208
Formula C36H34O14
Mw 690.1948558
CAS RN 386747-54-2
C_ID C00014904 ,
InChIKey CQLYGPZACBJXSX-WVSQWFNBNA-N
InChICode InChI=1S/C36H34O14/c1-13-12-17-22(35(41)47-13)26(38)21-16(30(17)50-36-34(46-7)33(45-6)29(44-5)14(2)48-36)9-8-15-20(21)27(39)24-28(40)23-18(42-3)10-11-19(43-4)31(23)49-32(24)25(15)37/h8-11,13-14,29,33-34,36,38H,12H2,1-7H3/t13-,14+,29+,33-,34+,36-/m0/s1
SMILES COc1ccc(OC)c2c(=O)c3c(oc12)C(=O)c1ccc2c(O[C@@H]4O[C@H](C)[C@@H](OC)[C@H](OC)[C@H]4OC)c4c(c(O)c2c1C3=O)C(=O)OC(C)C4
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaThermomonosporaceaeActinomadura sp. BL-42-PO13-046 Ref.
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