AMINOSALICYLATE CALCIUM

Details

Stereochemistry	ACHIRAL
Molecular Formula	2C7H6NO3.Ca.3H2O
Molecular Weight	398.379
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O.O.O.[Ca++].NC1=CC(O)=C(C=C1)C([O-])=O.NC2=CC(O)=C(C=C2)C([O-])=O

InChI

InChIKey=IPLQYSPEGHNJCQ-UHFFFAOYSA-L

InChI=1S/2C7H7NO3.Ca.3H2O/c2*8-4-1-2-5(7(10)11)6(9)3-4;;;;/h2*1-3,9H,8H2,(H,10,11);;3*1H2/q;;+2;;;/p-2

HIDE SMILES / InChI

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

Molecular Formula	C7H6NO3
Molecular Weight	152.1274
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
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 `Fri Dec 15 15:19:17 UTC 2023` Edited by `admin` on `Fri Dec 15 15:19:17 UTC 2023`
Record UNII	9VF16M7FWU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AMINOSALICYLATE CALCIUM

Systematic Name

English

BENZOIC ACID, 4-AMINO-2-HYDROXY-, CALCIUM SALT (2:1), TRIHYDRATE

Common Name

English

P-AMINOSALICYLIC ACID CALCIUM SALT TRIHYDRATE

Common Name

English

CALCIUM AMINOSALICYLATE [MART.]

Common Name

English

Calcium 4-aminosalicylate (1:2) trihydrate

Common Name

English

Aminosalicylate calcium trihydate [WHO-DD]

Common Name

English

CALCIUM AMINOSALICYLATE TRIHYDRATE

Systematic Name

English

CALCIUM AMINOSALICYLATE

Systematic Name

English

AMINOSALICYLATE CALCIUM TRIHYDATE

Systematic Name

English

NIPPAS CALCIUM

Brand Name

English

Classification Tree Code System Code

NCI_THESAURUS

C280