Chemical identity

Dihydrocinchonidine Sulphate

CAS 78848-93-8 · C19H24N2O : H2SO4

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-12951
PubChem CID23622934
NameDihydrocinchonidine Sulphate
CAS RN78848-93-8
Molecular formulaC19H24N2O : H2SO4
Molecular weight296.4 : 98.1 g/mol
IUPAC name(R)-((1S,2S,4S,5R)-5-ethylquinuclidin-2-yl)(quinolin-4-yl)methanol sulfate
InChIKeyJFIOPOZLTMPEKO-YYXOUSRLSA-N

02Structure identifiers

2D structurePubChem CID 23622934
2D structure: Dihydrocinchonidine Sulphate, CAS 78848-93-8
Structure of Dihydrocinchonidine Sulphate (CAS 78848-93-8). LazyChem record. Source identity: PubChem CID 23622934. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC19H24N2O : H2SO4
InChIKeyJFIOPOZLTMPEKO-YYXOUSRLSA-N
Ring count5
Defined stereocentres4
Unassigned stereocentres1
SMILESCC[C@H]1CN2CC[C@H]1C[C@H]2[C@@H](C3=CC=NC4=CC=CC=C34)O.OS(=O)(=O)O
InChIInChI=1S/C19H24N2O.H2O4S/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17;1-5(2,3)4/h3-7,9,13-14,18-19,22H,2,8,10-12H2,1H3;(H2,1,2,3,4)/t13-,14-,18-,19+;/m0./s1

03Stereochemistry

The published structure contains 4 defined and 1 unassigned tetrahedral stereocentres. The exact wedge-and-dash depiction is shown above.

Defined stereocentres42D structure
Unassigned stereocentres12D structure
Assignment statusPartially assignedExact published identity
Tetrahedral upper bound≤ 32Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNOT FOUND IN REVIEWED ENTRIESCAS 78848-93-8 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 78848-93-8 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

05Names and relationships

Associated parent compound

Quinine

View API and impurity family

Other names

  • cinchonan-9-ol, 10, 11-dihydro-, (8-alpha, 9r)-, sulfate (1:1) (salt)
  • Dihydrocinchonidine acid sulphate

Related records from the same parent family

06Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

07Sources