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131929-63-0
Catalog No.:AA009A7P

131929-63-0 | 1H-as-Indaceno3,2-doxacyclododecin-7,15-dione, 2-(6-deoxy-2,3,4-tri-O-methyl-.alpha.-L-mannopyranosyl)oxy-13-(2R,5S,6R)-5-(dimethylamino)tetrahydro-6-methyl-2H-pyran-2-yloxy-9-ethyl-2,3,3a,5a,5b,6,9,10,11,12,13,14,16a,16b-tetradecahydro-4,14-dimethyl-, (2

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Technical Information
Catalog Number:
AA009A7P
Chemical Name:
1H-as-Indaceno3,2-doxacyclododecin-7,15-dione, 2-(6-deoxy-2,3,4-tri-O-methyl-.alpha.-L-mannopyranosyl)oxy-13-(2R,5S,6R)-5-(dimethylamino)tetrahydro-6-methyl-2H-pyran-2-yloxy-9-ethyl-2,3,3a,5a,5b,6,9,10,11,12,13,14,16a,16b-tetradecahydro-4,14-dimethyl-, (2
CAS Number:
131929-63-0
Molecular Formula:
C42H67NO10
Molecular Weight:
745.9821
SMILES:
CC[C@H]1CCC[C@H](O[C@H]2CC[C@@H]([C@H](O2)C)N(C)C)[C@@H](C)C(=O)C2=C[C@@H]3[C@H]([C@@H]2CC(=O)O1)C=C(C)[C@H]1[C@H]3C[C@@H](C1)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1OC)OC)OC
Properties
Computed Properties
 
Complexity:
1330  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
17  
Heavy Atom Count:
53  
Hydrogen Bond Acceptor Count:
11  
Rotatable Bond Count:
9  
XLogP3:
4.8  

Literature

Title: Glycosylation engineering of spinosyn analogues containing an L-olivose moiety.

Journal: Organic & biomolecular chemistry 20090421

Title: The stereochemical outcome of electrophilic addition reactions on the 5,6-double bond in the spinosyns.

Journal: The Journal of organic chemistry 20011214

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SDS
Tags:131929-63-0 Molecular Formula|131929-63-0 MDL|131929-63-0 SMILES|131929-63-0 1H-as-Indaceno3,2-doxacyclododecin-7,15-dione, 2-(6-deoxy-2,3,4-tri-O-methyl-.alpha.-L-mannopyranosyl)oxy-13-(2R,5S,6R)-5-(dimethylamino)tetrahydro-6-methyl-2H-pyran-2-yloxy-9-ethyl-2,3,3a,5a,5b,6,9,10,11,12,13,14,16a,16b-tetradecahydro-4,14-dimethyl-, (2