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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H26N2O2.ClH
Molecular Weight 362.894
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AJMALINE HYDROCHLORIDE

SMILES

Cl.[H][C@@]12N(C)C3=C(C=CC=C3)[C@]14C[C@H]5[C@@H]([C@H]4O)[C@@]6([H])C[C@]2([H])N5[C@H](O)[C@H]6CC

InChI

InChIKey=FNCWZVOLGCRECX-LCJCZRDQSA-N
InChI=1S/C20H26N2O2.ClH/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24;/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3;1H/t10-,11-,14-,15-,16-,17-,18+,19+,20+;/m0./s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C20H26N2O2
Molecular Weight 326.4326
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:50:55 UTC 2023
Edited
by admin
on Fri Dec 15 18:50:55 UTC 2023
Record UNII
140MW6WGAF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AJMALINE HYDROCHLORIDE
WHO-DD  
Common Name English
AJMALINE MONOHYDROCHLORIDE
Common Name English
Ajmaline hydrochloride [WHO-DD]
Common Name English
AJMALAN-17,21-DIOL, MONOHYDROCHLORIDE, (17R,21.ALPHA.)-
Common Name English
Code System Code Type Description
SMS_ID
100000077985
Created by admin on Fri Dec 15 18:50:55 UTC 2023 , Edited by admin on Fri Dec 15 18:50:55 UTC 2023
PRIMARY
FDA UNII
140MW6WGAF
Created by admin on Fri Dec 15 18:50:55 UTC 2023 , Edited by admin on Fri Dec 15 18:50:55 UTC 2023
PRIMARY
CAS
4410-48-4
Created by admin on Fri Dec 15 18:50:55 UTC 2023 , Edited by admin on Fri Dec 15 18:50:55 UTC 2023
PRIMARY
PUBCHEM
76971380
Created by admin on Fri Dec 15 18:50:55 UTC 2023 , Edited by admin on Fri Dec 15 18:50:55 UTC 2023
PRIMARY
EPA CompTox
DTXSID50963171
Created by admin on Fri Dec 15 18:50:55 UTC 2023 , Edited by admin on Fri Dec 15 18:50:55 UTC 2023
PRIMARY
ECHA (EC/EINECS)
224-562-3
Created by admin on Fri Dec 15 18:50:55 UTC 2023 , Edited by admin on Fri Dec 15 18:50:55 UTC 2023
PRIMARY
EVMPD
SUB12755MIG
Created by admin on Fri Dec 15 18:50:55 UTC 2023 , Edited by admin on Fri Dec 15 18:50:55 UTC 2023
PRIMARY
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