input word = C00023650

Metabolite InformationStructural formula
Name Monodeacetylfusicoccin
F/IV
Formula C34H54O11
Mw 638.36661257
CAS RN 26543-87-3
C_ID C00023650 ,
InChIKey IEYDDQSCFAJEQD-HMIWLDRUNA-N
InChICode InChI=1S/C34H54O11/c1-9-33(5,6)43-16-24-28(38)29(39)30(40)32(44-24)45-31-26-22(17(2)14-42-19(4)35)12-25(36)34(26,7)13-23-20(15-41-8)10-11-21(23)18(3)27(31)37/h9,13,17-18,20-21,24-25,27-32,36-40H,1,10-12,14-16H2,2-8H3/b23-13-/t17-,18-,20-,21+,24-,25+,27-,28-,29+,30-,31-,32-,34+/m1/s1
SMILES [C@H]1([C@H]2C(=C[C@@]3(C(=C(C[C@@H]3O)[C@@H](COC(=O)C)C)[C@H]([C@@H]1O)O[C@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)COC(C=C)(C)C)C)[C@H](CC2)COC)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiBotryosphaeriaceaeFusicoccum amygdali Ref.
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