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CHEBI:80061 - Chivosazole E

ChEBI IDCHEBI:80061
ChEBI NameChivosazole E
Stars
DownloadsMolfile
FormulaC46H65NO12
Net Charge0
Average Mass824.021
Monoisotopic Mass823.45068
SMILESCC1=C\C(C)C(O[C@@H]2O[C@H](C)[C@@H](O)[C@H](O)[C@H]2O)/C=C\C=C\c2coc(n2)C(C)C(O)CC(O)/C=C/C=C/C=C\C(C)C(C(C)C(O)CC(C)O)OC(=O)/C=C\C=C/C=C\1
InChIInChI=1S/C46H65NO12/c1-28-18-12-8-11-15-23-40(52)59-44(32(5)37(50)25-31(4)48)29(2)19-13-9-10-14-21-36(49)26-38(51)33(6)45-47-35(27-56-45)20-16-17-22-39(30(3)24-28)58-46-43(55)42(54)41(53)34(7)57-46/h8-24,27,29-34,36-39,41-44,46,48-51,53-55H,25-26H2,1-7H3/b10-9+,11-8+,18-12-,19-13-,20-16+,21-14+,22-17-,23-15-,28-24+/t29?,30?,31?,32?,33?,34-,36?,37?,38?,39?,41-,42+,43-,44?,46+/m1/s1
InChIKeyUMUMBLZPRQHELQ-JMZWMVLASA-N
ChEBI Ontology
Outgoing Relation(s)
Chivosazole E (CHEBI:80061) is a glycoside (CHEBI:24400)
Manual XrefsDatabases
C15732KEGG COMPOUND