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CHEBI:80038 - Spinosyn H

ChEBI IDCHEBI:80038
ChEBI NameSpinosyn H
Stars
DownloadsMolfile
FormulaC40H63NO10
Net Charge0
Average Mass717.941
Monoisotopic Mass717.44520
SMILES[H][C@@]12C=C3C(=O)[C@H](C)[C@@H](O[C@H]4CC[C@H](N(C)C)[C@@H](C)O4)CCC[C@H](CC)OC(=O)C[C@@]3([H])[C@]1([H])C=C[C@]1([H])C[C@@H](O[C@@H]3O[C@@H](C)[C@H](OC)[C@@H](OC)[C@H]3O)C[C@@]21[H]
InChIInChI=1S/C40H63NO10/c1-9-25-11-10-12-33(51-35-16-15-32(41(5)6)22(3)47-35)21(2)36(43)31-19-29-27(30(31)20-34(42)49-25)14-13-24-17-26(18-28(24)29)50-40-37(44)39(46-8)38(45-7)23(4)48-40/h13-14,19,21-30,32-33,35,37-40,44H,9-12,15-18,20H2,1-8H3/t21-,22-,23+,24-,25+,26-,27-,28-,29-,30+,32+,33+,35+,37-,38+,39+,40+/m1/s1
InChIKeyIOCQRADVOJDJIS-SGFJDKLNSA-N
ChEBI Ontology
Outgoing Relation(s)
Spinosyn H (CHEBI:80038) is a macrolide (CHEBI:25106)
Manual XrefsDatabases
C15706KEGG COMPOUND