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Details

Stereochemistry ACHIRAL
Molecular Formula 2C5H7O3.Ca.2H2O
Molecular Weight 306.323
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CALCIUM LEVULINATE

SMILES

O.O.[Ca++].CC(=O)CCC([O-])=O.CC(=O)CCC([O-])=O

InChI

InChIKey=WQFDRFDIWAMOPA-UHFFFAOYSA-L
InChI=1S/2C5H8O3.Ca.2H2O/c2*1-4(6)2-3-5(7)8;;;/h2*2-3H2,1H3,(H,7,8);;2*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 HO
Molecular Weight 17.0073
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C5H8O3
Molecular Weight 116.1152
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 15:08:24 UTC 2023
Edited
by admin
on Fri Dec 15 15:08:24 UTC 2023
Record UNII
T6133SO781
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CALCIUM LEVULINATE
USP   EP  
Official Name English
CALCIUM LEVULINATE DIHYDRATE [EP MONOGRAPH]
Common Name English
CALCIUM LEVULINATE [VANDF]
Common Name English
PENTANOIC ACID, 4-OXO-, CALCIUM SALT (2:1), DIHYDRATE
Common Name English
CALCIUM LEVULINATE [USP MONOGRAPH]
Common Name English
CALCIUM LEVULINATE DIHYDRATE
EP  
Systematic Name English
CALCIUM LEVULINATE [MART.]
Common Name English
Calcium levulinate dihydrate [WHO-DD]
Common Name English
Calcium levulinate (1:2) dihydrate
Common Name English
CALCIUM LEVULINATE DIHYDRATE [EP IMPURITY]
Common Name English
CALCIUM LEVULINATE [USP-RS]
Common Name English
Code System Code Type Description
PUBCHEM
68651
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
PRIMARY
EVMPD
SUB11776MIG
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
PRIMARY
ChEMBL
CHEMBL1235931
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
PRIMARY
MESH
C032246
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
PRIMARY
FDA UNII
T6133SO781
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
PRIMARY
DRUG CENTRAL
4844
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
PRIMARY
RS_ITEM_NUM
1086935
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
PRIMARY
NCI_THESAURUS
C76833
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
PRIMARY
DRUG BANK
DB13800
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
PRIMARY
EPA CompTox
DTXSID8046539
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
PRIMARY
RXCUI
47624
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
PRIMARY RxNorm
NCI_THESAURUS
C1505
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
CONCEPT Dietary Supplement
CAS
5743-49-7
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
PRIMARY
EVMPD
SUB13187MIG
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
PRIMARY
SMS_ID
100000076387
Created by admin on Fri Dec 15 15:08:24 UTC 2023 , Edited by admin on Fri Dec 15 15:08:24 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY