input word = C00016708

Metabolite InformationStructural formula
Name ES-242-4
Formula C32H34O10
Mw 578.21519731
CAS RN 136565-69-0
C_ID C00016708 ,
InChIKey AVAQRWVGWWNBIN-UHFFFAOYNA-N
InChICode InChI=1S/C32H34O10/c1-13-29(33)27-19(11-41-13)31(35)23-17(7-15(37-3)9-21(23)39-5)25(27)26-18-8-16(38-4)10-22(40-6)24(18)32(36)20-12-42-14(2)30(34)28(20)26/h7-10,13-14,29-30,33-36H,11-12H2,1-6H3/t13-,14-,29-,30+/m1/s1
SMILES c12c(c(c3c(c1O)CO[C@@H]([C@H]3O)C)c1c3c(c(c4c1[C@H]([C@H](OC4)C)O)O)c(cc(c3)OC)OC)cc(cc2OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPlectosphaerellaceaeVerticillium sp. SPC-15898 Ref.
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OrganismVerticillium sp. SPC-15898
ReferenceToki,J.Antibiotics 45,(1992),1047