Isocorydine hydrochloride

C20H24ClNO4CAS 13552-72-2377.87 g/mol

OOHOONHCl
EtherPhenolTertiary amine

Properties

Molecular formula
C20H24ClNO4
Molar mass
377.87 g/mol
Exact mass
377.1394 Da
Melting point
200–210 °C
logP
3.59Crippen estimate
Polar surface area
51.2 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
3
Stereocentres
Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
13552-72-2
SMILES
COc1ccc2c(c1O)-c1c(OC)c(OC)cc3c1[C@H](C2)N(C)CC3.Cl
InChIKey
ZWSKLEMBDRWSNZ-ZOWNYOTGSA-N
InChI
InChI=1S/C20H23NO4.ClH/c1-21-8-7-12-10-15(24-3)20(25-4)18-16(12)13(21)9-11-5-6-14(23-2)19(22)17(11)18;/h5-6,10,13,22H,7-9H2,1-4H3;1H/t13-;/m0./s1

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Names and synonyms

5 names
  • 4H-Dibenzo[de,g]quinolin-11-ol, 5,6,6a,7-tetrahydro-1,2,10-trimethoxy-6-methyl-, hydrochloride (1:1), (6aS)-
  • 6Aα-Aporphin-11-ol, 1,2,10-trimethoxy-, hydrochloride
  • 4H-Dibenzo[de,g]quinolin-11-ol, 5,6,6a,7-tetrahydro-1,2,10-trimethoxy-6-methyl-, hydrochloride, (S)-
  • 4H-Dibenzo[de,g]quinolin-11-ol, 5,6,6a,7-tetrahydro-1,2,10-trimethoxy-6-methyl-, hydrochloride, (6aS)-
  • (+)-Isocorydine hydrochloride

Work with Isocorydine hydrochloride

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Elsewhere