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Details

Stereochemistry ACHIRAL
Molecular Formula C12H6N2O8S.2Sr.8H2O
Molecular Weight 657.61
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of STRONTIUM RANELATE OCTAHYDRATE

SMILES

O.O.O.O.O.O.O.O.[Sr++].[Sr++].[O-]C(=O)CN(CC([O-])=O)C1=C(C#N)C(CC([O-])=O)=C(S1)C([O-])=O

InChI

InChIKey=ZHEZAQJNZMLYBA-UHFFFAOYSA-J
InChI=1S/C12H10N2O8S.8H2O.2Sr/c13-2-6-5(1-7(15)16)10(12(21)22)23-11(6)14(3-8(17)18)4-9(19)20;;;;;;;;;;/h1,3-4H2,(H,15,16)(H,17,18)(H,19,20)(H,21,22);8*1H2;;/q;;;;;;;;;2*+2/p-4

HIDE SMILES / InChI

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

Molecular Formula Sr
Molecular Weight 87.62
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C12H10N2O8S
Molecular Weight 342.281
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 18:35:28 UTC 2023
Edited
by admin
on Fri Dec 15 18:35:28 UTC 2023
Record UNII
8PD4806E06
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
STRONTIUM RANELATE OCTAHYDRATE
Common Name English
DISTRONTIUM RENELATE OCTAHYDRATE
Common Name English
3-THIOPHENEACETIC ACID, 5-(BIS(CARBOXYMETHYL)AMINO)-2-CARBOXY-4-CYANO-, STRONTIUM SALT (1:2), OCTAHYDRATE
Common Name English
Code System Code Type Description
CAS
674773-15-0
Created by admin on Fri Dec 15 18:35:28 UTC 2023 , Edited by admin on Fri Dec 15 18:35:28 UTC 2023
PRIMARY
EPA CompTox
DTXSID00217833
Created by admin on Fri Dec 15 18:35:28 UTC 2023 , Edited by admin on Fri Dec 15 18:35:28 UTC 2023
PRIMARY
EVMPD
SUB193441
Created by admin on Fri Dec 15 18:35:28 UTC 2023 , Edited by admin on Fri Dec 15 18:35:28 UTC 2023
PRIMARY
PUBCHEM
71300750
Created by admin on Fri Dec 15 18:35:28 UTC 2023 , Edited by admin on Fri Dec 15 18:35:28 UTC 2023
PRIMARY
FDA UNII
8PD4806E06
Created by admin on Fri Dec 15 18:35:28 UTC 2023 , Edited by admin on Fri Dec 15 18:35:28 UTC 2023
PRIMARY
SMS_ID
100000177885
Created by admin on Fri Dec 15 18:35:28 UTC 2023 , Edited by admin on Fri Dec 15 18:35:28 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
ANHYDROUS->SOLVATE
PARENT -> SALT/SOLVATE