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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H26N2O5
Molecular Weight 422.4736
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALSTONIDINE ACETATE

SMILES

COC(=O)C1=CO[C@@H](C)[C@H](COC(C)=O)[C@@H]1CC2=C3N(C)C4=C(C=CC=C4)C3=CC=N2

InChI

InChIKey=PBFFUBUODGPIFL-JVPBZIDWSA-N
InChI=1S/C24H26N2O5/c1-14-19(12-31-15(2)27)18(20(13-30-14)24(28)29-4)11-21-23-17(9-10-25-21)16-7-5-6-8-22(16)26(23)3/h5-10,13-14,18-19H,11-12H2,1-4H3/t14-,18-,19-/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H26N2O5
Molecular Weight 422.4736
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:17:23 GMT 2023
Edited
by admin
on Sat Dec 16 09:17:23 GMT 2023
Record UNII
25J288L711
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ALSTONIDINE ACETATE
Common Name English
ALSTONIDINE, ACETATE (ESTER)
Common Name English
O-ACETYLALSTONIDINE
Common Name English
Code System Code Type Description
FDA UNII
25J288L711
Created by admin on Sat Dec 16 09:17:23 GMT 2023 , Edited by admin on Sat Dec 16 09:17:23 GMT 2023
PRIMARY
PUBCHEM
72710699
Created by admin on Sat Dec 16 09:17:23 GMT 2023 , Edited by admin on Sat Dec 16 09:17:23 GMT 2023
PRIMARY
CAS
31148-66-0
Created by admin on Sat Dec 16 09:17:23 GMT 2023 , Edited by admin on Sat Dec 16 09:17:23 GMT 2023
PRIMARY
Related Record Type Details
SOLVATE->ANHYDROUS