U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C10H10O5.Ca
Molecular Weight 250.261
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PROHEXADIONE-CALCIUM

SMILES

[Ca++].CCC(=O)[C-]1C(=O)CC(CC1=O)C([O-])=O

InChI

InChIKey=TYBVOPGCAAQHNM-UHFFFAOYSA-M
InChI=1S/C10H11O5.Ca/c1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13;/h5H,2-4H2,1H3,(H,14,15);/q-1;+2/p-1

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 C10H11O5
Molecular Weight 211.1913
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 00:00:34 GMT 2023
Edited
by admin
on Sat Dec 16 00:00:34 GMT 2023
Record UNII
U279R462WB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PROHEXADIONE-CALCIUM
HSDB   ISO  
Common Name English
VIVIFUL
Brand Name English
PROHEXADIONE CALCIUM SALT [MI]
Common Name English
BX-112
Code English
KIM-112
Code English
PROHEXADIONE CALCIUM SALT
MI  
Common Name English
3,5-DIOXO-4-(1-OXOPROPYL)CYCLOHEXANECARBOXYLIC ACID CALCIUM SALT (1:1)
Common Name English
KUH-833
Code English
MEDAX
Brand Name English
PROHEXADIONE CALCIUM
Common Name English
CALCIUM 3-OXIDO-5-OXO-4-PROPIONYLCYCLOHEX-3-ENECARBOXYLATE
Systematic Name English
PROHEXADIONE-CALCIUM [ISO]
Common Name English
PROHEXADIONE-CALCIUM [HSDB]
Common Name English
CYCLOHEXANECARBOXYLIC ACID, 3,5-DIOXO-4-(1-OXOPROPYL)-, ION(1-), CALCIUM, CALCIUM SALT (2:1:1)
Systematic Name English
APOGEE PLANT GROWTH REGULATOR
Brand Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 112600
Created by admin on Sat Dec 16 00:00:34 GMT 2023 , Edited by admin on Sat Dec 16 00:00:34 GMT 2023
Code System Code Type Description
CHEBI
137425
Created by admin on Sat Dec 16 00:00:34 GMT 2023 , Edited by admin on Sat Dec 16 00:00:34 GMT 2023
PRIMARY
FDA UNII
U279R462WB
Created by admin on Sat Dec 16 00:00:34 GMT 2023 , Edited by admin on Sat Dec 16 00:00:34 GMT 2023
PRIMARY
MERCK INDEX
m9162
Created by admin on Sat Dec 16 00:00:34 GMT 2023 , Edited by admin on Sat Dec 16 00:00:34 GMT 2023
PRIMARY Merck Index
CAS
127277-53-6
Created by admin on Sat Dec 16 00:00:34 GMT 2023 , Edited by admin on Sat Dec 16 00:00:34 GMT 2023
PRIMARY
HSDB
7252
Created by admin on Sat Dec 16 00:00:34 GMT 2023 , Edited by admin on Sat Dec 16 00:00:34 GMT 2023
PRIMARY
EPA CompTox
DTXSID9034496
Created by admin on Sat Dec 16 00:00:34 GMT 2023 , Edited by admin on Sat Dec 16 00:00:34 GMT 2023
PRIMARY
ALANWOOD
prohexadione-calcium
Created by admin on Sat Dec 16 00:00:34 GMT 2023 , Edited by admin on Sat Dec 16 00:00:34 GMT 2023
PRIMARY