CHEBI:201442 - Spinosyn L

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ChEBI Name Spinosyn L
ChEBI ID CHEBI:201442
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C41H65NO10
Net Charge 0
Average Mass 731.968
Monoisotopic Mass 731.46085
InChI InChI=1S/C41H65NO10/c1-10-25-12-11-13-34(52-36-15-14-33(42(6)7)23(4)48-36)22(3)37(44)32-19-30-28(31(32)20-35(43)50-25)16-21(2)27-17-26(18-29(27)30)51-41-40(47-9)38(45)39(46-8)24(5)49-41/h16,19,22-31,33-34,36,38-41,45H,10-15,17-18,20H2,1-9H3
InChIKey OGERNURWPFGCDC-UHFFFAOYSA-N
SMILES O=C1C2=CC3C4C(CC(C4)OC5OC(C(OC)C(C5OC)O)C)C(=CC3C2CC(=O)OC(CC)CCCC(C1C)OC6OC(C(N(C)C)CC6)C)C
ChEBI Ontology
Outgoing Spinosyn L (CHEBI:201442) is a aminoglycoside (CHEBI:47779)
IUPAC Name
(1S,2R,5S,7R,9R,10S,14R,15S,19S)-15-[(2R,5S,6R)-5-(dimethylamino)-6-methyloxan-2-yl]oxy-19-ethyl-7-[(2R,3R,4R,5R,6S)-4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl]oxy-4,14-dimethyl-20-oxatetracyclo[10.10.0.02,10.05,9]docosa-3,11-diene-13,21-dione