Serpentine hydrochloride

methyl (15R,16S,20S)-16-methyl-17-oxa-3-aza-13-azoniapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),2(10),4,6,8,11,18-heptaene-19-carboxylate chloride

CAS: 55322-91-3

Molecular Formula	`C21H21ClN2O3`
Molecular Weight	384.9 g/mol
Topological Polar Surface Area	55.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	2
Exact Mass	384.12408
Heavy Atoms	27
Complexity	606.0

Chemical Identifiers

CAS Number	55322-91-3
SMILES	`CC1C2C[N+]3=C(CC2C(=CO1)C(=O)OC)C4=C(C=C3)C5=CC=CC=C5N4.[Cl-]`
InChIKey	`HKPNHORYVYLABA-RXAPEJBRSA-N`

📖 Product Overview

Serpentine hydrochloride (CAS: 55322-91-3) is a chemical compound with molecular formula C21H21ClN2O3 and molecular weight 384.9 g/mol. Its IUPAC systematic name is methyl (15R,16S,20S)-16-methyl-17-oxa-3-aza-13-azoniapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),2(10),4,6,8,11,18-heptaene-19-carboxylate chloride. Topological Polar Surface Area 55.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 2 Exact Mass 384.12408 Heavy Atoms 27 Complexity 606.0 InChI Key: HKPNHORYVYLABA-RXAPEJBRSA-N. SMILES: CC1C2C[N+]3=C(CC2C(=CO1)C(=O)OC)C4=C(C=C3)C5=CC=CC=C5N4.[Cl-].

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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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