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Chemical structure of Spinosyn D 17-pseudoaglycone

GC44939

Spinosyn D 17-pseudoaglycone

Also known as (1S,2S,5R,7S,9S,10S,14R,15S,19S)-19-ethyl-15-hydroxy-4,14-dimethyl-7-[(2R,3R,4R,5S,6S)-3,4,5-trimethoxy-6-methyloxan-2-yl]oxy-20-oxatetracyclo[10.10.0.02,10.05,9]docosa-3,11-diene-13,21-dione

Spinosyn D 17-pseudoaglycone is a hydrolysis product of the minor insecticide component spinosyn D

ChemicalCAS131929-55-0MW604.8FormulaC34H52O9
CAS number
131929-55-0
Molecular weight
604.8
Formula
C34H52O9
Solubility
Soluble in DMSO
InChIKey
PGGPPEHRBUYMQU-QEGHUGIASA-N
Catalogue number
GC44939
Brand
GLPBIO
Computed properties PubChem CID 10722365 · XLogP 3.3 · TPSA 110 Ų · H-bond donors 1
XLogP
3.3
TPSA
110 Ų
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
6
Heavy atoms
43

SMILES CC[C@H]1CCC[C@@H]([C@H](C(=O)C2=C[C@H]3[C@@H]4C[C@@H](C[C@H]4C(=C[C@H]3[C@@H]2CC(=O)O1)C)O[C@H]5[C@@H]([C@@H]([C@H]([C@@H](O5)C)OC)OC)OC)C)O

Computed descriptors from PubChem (CID 10722365), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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