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CHEBI:80059 - Chivosazole C

Default Structure
ChEBI IDCHEBI:80059
ChEBI NameChivosazole C
Stars
DownloadsMolfile
FormulaC47H67NO12
Net Charge0
Average Mass838.048
Monoisotopic Mass837.46633
SMILESCOC1CC(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/C(C)=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)C1C
InChIInChI=1S/C47H67NO12/c1-29-19-13-9-12-16-24-41(52)60-45(33(5)38(51)26-32(4)49)30(2)20-14-10-11-15-22-37(50)27-40(56-8)34(6)46-48-36(28-57-46)21-17-18-23-39(31(3)25-29)59-47-44(55)43(54)42(53)35(7)58-47/h9-25,28,30-35,37-40,42-45,47,49-51,53-55H,26-27H2,1-8H3/b11-10+,12-9+,19-13-,20-14-,21-17+,22-15+,23-18-,24-16-,29-25+/t30?,31?,32?,33?,34?,35-,37?,38?,39?,40?,42-,43+,44-,45?,47+/m1/s1
InChIKeyOTUVKXUFJAKVNU-VWWXXOFZSA-N
ChEBI Ontology
Outgoing Relation(s)
Chivosazole C (CHEBI:80059) is a organic molecular entity (CHEBI:50860)
Manual XrefsDatabases
C15730KEGG COMPOUND