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Details

Stereochemistry EPIMERIC
Molecular Formula C20H21N7O7.Ca.5H2O
Molecular Weight 601.578
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LEUCOVORIN CALCIUM PENTAHYDRATE

SMILES

O.O.O.O.O.[Ca++].NC1=NC(=O)C2=C(NCC(CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)N2C=O)N1

InChI

InChIKey=NPPBLUASYYNAIG-ZIGBGYJWSA-L
InChI=1S/C20H23N7O7.Ca.5H2O/c21-20-25-16-15(18(32)26-20)27(9-28)12(8-23-16)7-22-11-3-1-10(2-4-11)17(31)24-13(19(33)34)5-6-14(29)30;;;;;;/h1-4,9,12-13,22H,5-8H2,(H,24,31)(H,29,30)(H,33,34)(H4,21,23,25,26,32);;5*1H2/q;+2;;;;;/p-2/t12?,13-;;;;;;/m0....../s1

HIDE SMILES / InChI
Molecular Formula C20H23N7O7
Molecular Weight 473.4393
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 1 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED
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 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

Unknown
86413
Substance Class Chemical
Created
by admin
on Sat Dec 16 08:35:22 UTC 2023
Edited
by admin
on Sat Dec 16 08:35:22 UTC 2023
Record UNII
R3W57OBQ5W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LEUCOVORIN CALCIUM PENTAHYDRATE
Common Name English
RESCUFOLIN
Brand Name English
CALCIUM N-(P-(((2-AMINO-5-FORMYL-5,6,7,8-TETRAHYDRO-4-HYDROXY-6-PTERIDINYL)METHYL)AMINO)BENZOYL)-L-GLUTAMATE (1:1) PENTAHYDRATE [WHO-IP]
Systematic Name English
LEUCOSAR
Brand Name English
Calcium folinate pentahydrate [WHO-DD]
Common Name English
FOLINIC ACID, CALCIUM SALT PENTAHYDRATE
Common Name English
LEUCOVORIN CALCIUM [WHO-IP]
Common Name English
WELLCOVORIN
Brand Name English
LEDERFOLAT
Brand Name English
CALCIUM FOLINATE [WHO-IP]
Common Name English
FOLINIC ACID CALCIUM SALT PENTAHYDRATE
MI  
Common Name English
FOLAREN
Brand Name English
RESCUVOLIN
Brand Name English
CALCII FOLINAS [WHO-IP LATIN]
Common Name English
TONOFOLIN
Brand Name English
CALCIUM FOLINATE PENTAHYDRATE
WHO-DD  
Common Name English
LEDERFOLIN
Brand Name English
FOLINIC ACID CALCIUM SALT PENTAHYDRATE [MI]
Common Name English
FOLIBEN
Brand Name English
L-GLUTAMIC ACID, N-(4-(((2-AMINO-5-FORMYL-3,4,5,6,7,8-HEXAHYDRO-4-OXO-6-PTERIDINYL)METHYL)AMINO)BENZOYL)-, CALCIUM SALT, HYDRATE (1:1:5)
Systematic Name English
Code System Code Type Description
WHO INTERNATIONAL PHARMACOPEIA
LEUCOVORIN CALCIUM PENTAHYDRATE
Created by admin on Sat Dec 16 08:35:22 UTC 2023 , Edited by admin on Sat Dec 16 08:35:22 UTC 2023
PRIMARY Description: A white or creamy white powder; odourless. Solubility: Very soluble in water; practically insoluble in ethanol (~750 g/l) TS. Category: Cytotoxic drug. Storage: Calcium folinate should be kept in a well-closed container, protected from light. Additional information: CAUTION: Calcium folinate must be handled with care, avoiding contact with the skin and inhalation of airborne particles. Definition: Calcium folinate contains not less than 95.0% and not more than 105.0% of C20H21CaN7O7, calculated with reference to the anhydrous substance.
CAS
6035-45-6
Created by admin on Sat Dec 16 08:35:22 UTC 2023 , Edited by admin on Sat Dec 16 08:35:22 UTC 2023
PRIMARY
SMS_ID
100000137727
Created by admin on Sat Dec 16 08:35:22 UTC 2023 , Edited by admin on Sat Dec 16 08:35:22 UTC 2023
PRIMARY
DRUG BANK
DBSALT001441
Created by admin on Sat Dec 16 08:35:22 UTC 2023 , Edited by admin on Sat Dec 16 08:35:22 UTC 2023
PRIMARY
FDA UNII
R3W57OBQ5W
Created by admin on Sat Dec 16 08:35:22 UTC 2023 , Edited by admin on Sat Dec 16 08:35:22 UTC 2023
PRIMARY
PUBCHEM
135802074
Created by admin on Sat Dec 16 08:35:22 UTC 2023 , Edited by admin on Sat Dec 16 08:35:22 UTC 2023
PRIMARY
EPA CompTox
DTXSID3036999
Created by admin on Sat Dec 16 08:35:22 UTC 2023 , Edited by admin on Sat Dec 16 08:35:22 UTC 2023
PRIMARY
MERCK INDEX
m5519
Created by admin on Sat Dec 16 08:35:22 UTC 2023 , Edited by admin on Sat Dec 16 08:35:22 UTC 2023
PRIMARY Merck Index
EVMPD
SUB76309
Created by admin on Sat Dec 16 08:35:22 UTC 2023 , Edited by admin on Sat Dec 16 08:35:22 UTC 2023
PRIMARY
Related Record Type Details
Structure of LEUCOVORIN
PARENT -> SALT/SOLVATE
Structure of LEUCOVORIN CALCIUM
ANHYDROUS->SOLVATE
NIH
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