Agn-PC-0loici structure

Agn-PC-0loici

2-chloroethyl N-[4-[(2,4-dimethoxyphenyl)carbamoyloxy]-15,16-bis(4-hydroxybutyl)-12-phenylmethoxyimino-9-prop-2-enoxy-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-2(7),3,5,13-tetraen-10-yl]-N-[(4-fluorophenyl)methyl]carbamate

Also Known As: AGN-PC-0LOICI|CLL1_007411|4-[(Benzyloxy)imino]-6-{[(2-chloroethoxy)carbonyl][(4-fluorophenyl)methyl]amino}-1,2-bis(4-hydroxybutyl)-6a-[(prop-2-en-1-yl)oxy]-1,2,4,5,6,6a,11b,11c-octahydrobenzo[kl]xanthen-10-yl (2,4-dimethoxyphenyl)carbamate

CAS: 5211-22-3
Molecular Formula C53H61ClFN3O11
Molecular Weight 969.3979 g/mol
LogP 10.1652
Topological Polar Surface Area 166.84 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 12
Rotatable Bonds 23
Exact Mass 969.3979
Monoisotopic Mass 969.3979
Heavy Atoms 69
Complexity 2421.5225

Chemical Identifiers

CAS Number 5211-22-3
SMILES COC1=CC(=C(C=C1)NC(=O)OC2=CC3=C(C=C2)OC4(C(CC(=NOCC5=CC=CC=C5)C6=CC(C(C3C64)CCCCO)CCCCO)N(CC7=CC=C(C=C7)F)C(=O)OCCCl)OCC=C)OC

Product Overview

Agn-PC-0loici (CAS 5211-22-3), with molecular formula C53H61ClFN3O11 and molecular weight 969.3979 g/mol. IUPAC: 2-chloroethyl N-[4-[(2,4-dimethoxyphenyl)carbamoyloxy]-15,16-bis(4-hydroxybutyl)-12-phenylmethoxyimino-9-prop-2-enoxy-8-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-2(7),3,5,13-tetraen-10-yl]-N-[(4-fluorophenyl)methyl]carbamate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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