input word = C00012135

Metabolite InformationStructural formula
Name Vicolide C
Formula C22H32O9
Mw 440.20463262
CAS RN 81623-28-1
C_ID C00012135 ,
InChIKey JBZUUXNUAXEKGK-OQKQMSNLNA-N
InChICode InChI=1S/C22H32O9/c1-7-9(2)20(26)29-16-14-11(4)21(27)30-17(14)18(25)22(6)19(31-22)13(24)8-10(3)15(16)28-12(5)23/h9-10,13-19,24-25H,4,7-8H2,1-3,5-6H3/t9-,10-,13-,14-,15-,16-,17+,18-,19-,22+/m1/s1
SMILES [C@@H]1([C@]2([C@@H]([C@@H](C[C@H]([C@H]([C@@H]([C@@H]3[C@@H]1OC(=O)C3=C)OC(=O)[C@H](C)CC)OC(=O)C)C)O)O2)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Vicoa indica Ref.
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OrganismVicoa indica
ReferencePurushothaman,J. Chem. Res. (S),(1981),374