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Details

Stereochemistry ABSOLUTE
Molecular Formula 2C19H21N2O3.Ca
Molecular Weight 690.841
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUMADIZONE CALCIUM ANHYDROUS, (S)-

SMILES

[Ca++].CCCC[C@H](C([O-])=O)C(=O)N(NC1=CC=CC=C1)C2=CC=CC=C2.CCCC[C@H](C([O-])=O)C(=O)N(NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChIKey=RKINNRASCJRSHD-OOZXSOIMSA-L
InChI=1S/2C19H22N2O3.Ca/c2*1-2-3-14-17(19(23)24)18(22)21(16-12-8-5-9-13-16)20-15-10-6-4-7-11-15;/h2*4-13,17,20H,2-3,14H2,1H3,(H,23,24);/q;;+2/p-2/t2*17-;/m00./s1

HIDE SMILES / InChI

Molecular Formula C19H21N2O3
Molecular Weight 325.3816
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula Ca
Molecular Weight 40.078
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:55:55 GMT 2023
Edited
by admin
on Sat Dec 16 01:55:55 GMT 2023
Record UNII
020ZEC51XU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUMADIZONE CALCIUM ANHYDROUS, (S)-
Common Name English
PROPANEDIOIC ACID, 2-BUTYL-, 1-(1,2-DIPHENYLHYDRAZIDE), CALCIUM SALT (2:1), (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
76964353
Created by admin on Sat Dec 16 01:55:55 GMT 2023 , Edited by admin on Sat Dec 16 01:55:55 GMT 2023
PRIMARY
FDA UNII
020ZEC51XU
Created by admin on Sat Dec 16 01:55:55 GMT 2023 , Edited by admin on Sat Dec 16 01:55:55 GMT 2023
PRIMARY
Related Record Type Details
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