(8Z)-5-O-Demethylavermectin A1a
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(8Z)-5-O-Demethylavermectin A1a
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CAS No:
113665-89-7
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Formula:
C48H72O14
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Chemical Name:
(8Z)-5-O-Demethylavermectin A1a
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Synonyms:
Avermectin A1a,5-O-demethyl-,(8Z)-;Spiro[11,15-methano-2H,13H,17H-furo[4,3,2-pq][2,6]benzodioxacyclooctadecin-13,2′-[2H]pyran],avermectin A1a deriv.;(8Z)-5-O-Demethylavermectin A1a;8,9-Z-Abamectin B1a
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CAS No:
Safety Information
|Danger|H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral]|P201, P202, P264, P270, P273, P281, P301+P310, P308+P313, P321, P330, P391, P405, and P501|Aggregated GHS information provided by 90 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:873.1
XLogP3:3.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:14
Rotatable Bond Count:8
Exact Mass:872.49220697
Monoisotopic Mass:872.49220697
Topological Polar Surface Area:170
Heavy Atom Count:62
Complexity:1730
Defined Atom Stereocenter Count:9
Undefined Atom Stereocenter Count:11
Defined Bond Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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