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CHEBI:1442 - 3-Acetyl-1-tigloylazadirachtinin

ChEBI IDCHEBI:1442
ChEBI Name3-Acetyl-1-tigloylazadirachtinin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC35H44O16
Net Charge0
Average Mass720.721
Monoisotopic Mass720.26294
SMILES[H][C@@]12OC=C[C@]1(O)[C@@H]1C[C@H](O2)[C@]2(O)[C@]3(C)[C@H](O[C@]12C)[C@]1([H])OC[C@]2(C(=O)OC)[C@H](OC(C)=O)C[C@H](OC(=O)/C(C)=C/C)[C@@]4(CO[C@](O)(C(=O)OC)[C@@]34[H])[C@@]12[H]
InChIInChI=1S/C35H44O16/c1-8-15(2)24(37)49-18-12-19(48-16(3)36)32(26(38)43-6)13-46-21-22(32)31(18)14-47-34(41,27(39)44-7)25(31)29(4)23(21)51-30(5)17-11-20(35(29,30)42)50-28-33(17,40)9-10-45-28/h8-10,17-23,25,28,40-42H,11-14H2,1-7H3/b15-8+/t17-,18+,19-,20+,21-,22-,23-,25+,28+,29-,30-,31+,32+,33+,34+,35+/m1/s1
InChIKeyPRHIFRRGZHSCGI-WKVRWLKDSA-N
ChEBI Ontology
Outgoing Relation(s)
3-Acetyl-1-tigloylazadirachtinin (CHEBI:1442) is a sesquiterpenoid (CHEBI:26658)
Synonym  Source
3-Acetyl-1-tigloylazadirachtininKEGG COMPOUND
Manual XrefsDatabases
C11047KEGG COMPOUND