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Details

Stereochemistry EPIMERIC
Molecular Formula C22H27N2O3.Cl
Molecular Weight 402.914
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MELINONINE A CHLORIDE

SMILES

[Cl-].[H][C@]12C[N+]3(C)CCC4=C(NC5=C4C=CC=C5)[C@]3([H])C[C@]1([H])C(=CO[C@H]2C)C(=O)OC

InChI

InChIKey=MEQZFTXZSJSEQT-NTLKUVPSSA-M
InChI=1S/C22H27N2O3.ClH/c1-13-17-11-24(2)9-8-15-14-6-4-5-7-19(14)23-21(15)20(24)10-16(17)18(12-27-13)22(25)26-3;/h4-7,12-13,16-17,20,23H,8-11H2,1-3H3;1H/q+1;/p-1/t13-,16-,17+,20-,24?;/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 C22H27N2O3
Molecular Weight 367.4614
Charge 1
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 4 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:44:28 UTC 2023
Edited
by admin
on Sat Dec 16 09:44:28 UTC 2023
Record UNII
5B476K30QA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MELINONINE A CHLORIDE
MI  
Common Name English
(19.ALPHA.)-16,17-DIDEHYDRO-16-(METHOXYCARBONYL)-4,19-DIMETHYLOXAYOHIMBANIUM CHLORIDE
Systematic Name English
MELINONINE A CHLORIDE [MI]
Common Name English
Code System Code Type Description
MERCK INDEX
m305
Created by admin on Sat Dec 16 09:44:28 UTC 2023 , Edited by admin on Sat Dec 16 09:44:28 UTC 2023
PRIMARY Merck Index
FDA UNII
5B476K30QA
Created by admin on Sat Dec 16 09:44:28 UTC 2023 , Edited by admin on Sat Dec 16 09:44:28 UTC 2023
PRIMARY
PUBCHEM
91668154
Created by admin on Sat Dec 16 09:44:28 UTC 2023 , Edited by admin on Sat Dec 16 09:44:28 UTC 2023
PRIMARY
CAS
114537-53-0
Created by admin on Sat Dec 16 09:44:28 UTC 2023 , Edited by admin on Sat Dec 16 09:44:28 UTC 2023
PRIMARY