Tetraphylline nitrate structure

Tetraphylline nitrate

methyl 6-methoxy-16-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4(9),5,7,18-pentaene-19-carboxylate;nitric acid

Also Known As: Tetraphylline nitrate|TETRAPHYLLINE, NITRATE|Nitric acid--methyl 11-methoxy-19-methyl-16,17-didehydro-18-oxayohimban-16-carboxylate (1/1)

CAS: 4833-83-4
Molecular Formula C22H27N3O7
Molecular Weight 445.1849 g/mol
LogP 2.8397
Topological Polar Surface Area 127.16 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 7
Rotatable Bonds 2
Exact Mass 445.1849
Monoisotopic Mass 445.1849
Heavy Atoms 32
Complexity 1059.2169

Chemical Identifiers

CAS Number 4833-83-4
SMILES CC1C2CN3CCC4=C(C3CC2C(=CO1)C(=O)OC)NC5=C4C=CC(=C5)OC.[N+](=O)(O)[O-]

Product Overview

Tetraphylline nitrate (CAS 4833-83-4), with molecular formula C22H27N3O7 and molecular weight 445.1849 g/mol. IUPAC: methyl 6-methoxy-16-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4(9),5,7,18-pentaene-19-carboxylate;nitric acid.

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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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