CAS Registry Number®
6681-15-8
CAS Name
Jatrorrhizine chloride
Molecular Formula
C20H20NO4.Cl
Compound Properties
-
Melting Point (1)
208-210 °C
Source(s)
- (1) Wu, Wu-Nan; Taiwan Pharmaceutical Journal, (2007), 59(2), 73-84, CAplus
Other Names and Identifiers
InChI
InChI=1S/C20H19NO4.ClH/c1-23-18-5-4-12-8-16-14-10-19(24-2)17(22)9-13(14)6-7-21(16)11-15(12)20(18)25-3;/h4-5,8-11H,6-7H2,1-3H3;1H
InChIKey
InChIKey=JKMUUZMCSNHBAX-UHFFFAOYSA-N
SMILES
O(C)C=1C=C2C=3[N+](=CC=4C(C3)=CC=C(OC)C4OC)CCC2=CC1O.[Cl-]
Canonical SMILES
[Cl-].OC=1C=C2C(=CC1OC)C=3C=C4C=CC(OC)=C(OC)C4=C[N+]3CC2
Other Names for this Substance
- Dibenzo[a,g]quinolizinium, 5,6-dihydro-3-hydroxy-2,9,10-trimethoxy-, chloride (1:1)
- Berbinium, 7,8,13,13a-tetradehydro-3-hydroxy-2,9,10-trimethoxy-, chloride
- Jatrorrhizine chloride
- Dibenzo[a,g]quinolizinium, 5,6-dihydro-3-hydroxy-2,9,10-trimethoxy-, chloride
- Neprotine chloride
- NSC 645313
Deleted or Replaced CAS Registry Numbers
960383-96-4, 1198398-69-4
