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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H26N2O2
Molecular Weight 326.4326
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AJMALINE

SMILES

[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=CJDRUOGAGYHKKD-RQBLFBSQSA-N
InChI=1S/C20H26N2O2/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/t10-,11-,14-,15-,16-,17-,18+,19+,20+/m0/s1

HIDE SMILES / InChI
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

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 14:57:54 UTC 2023
Edited
by admin
on Fri Dec 15 14:57:54 UTC 2023
Record UNII
1PON08459R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AJMALINE
MART.   MI   WHO-DD  
Common Name English
AJMALINE [MI]
Common Name English
(17R,21R)-AJMALAN-17,21-DIOL
Common Name English
AJMALINE [MART.]
Common Name English
AJMALAN-17,21-DIOL
Common Name English
RAUWOLFINE
Common Name English
AJMALINE [JAN]
Common Name English
Ajmaline [WHO-DD]
Common Name English
NSC-15627
Code English
Classification Tree Code System Code
WHO-VATC QC01BA05
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
WHO-ATC C01BA05
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
NCI_THESAURUS C47793
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
Code System Code Type Description
EVMPD
SUB12754MIG
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
MESH
D000404
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
NSC
15627
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
DRUG CENTRAL
100
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
ECHA (EC/EINECS)
224-439-4
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
WIKIPEDIA
AJMALINE
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
CHEBI
58567
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
ChEMBL
CHEMBL2105617
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
CAS
4360-12-7
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
CHEBI
28462
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
EPA CompTox
DTXSID6045537
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
SMS_ID
100000077965
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
MERCK INDEX
m1457
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY Merck Index
NCI_THESAURUS
C83524
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
PUBCHEM
6100671
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
FDA UNII
1PON08459R
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
RXCUI
423
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY RxNorm
DRUG BANK
DB01426
Created by admin on Fri Dec 15 14:57:54 UTC 2023 , Edited by admin on Fri Dec 15 14:57:54 UTC 2023
PRIMARY
Related Record Type Details
Structure of AJMALINE MONOETHANOLATE
SOLVATE->ANHYDROUS
Structure of AJMALINE HYDROCHLORIDE
SALT/SOLVATE -> PARENT
Structure of AJMALINE MONOETHANOLATE
SALT/SOLVATE -> PARENT
Related Record Type Details
Structure of AJMALINE
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