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Details

Stereochemistry ABSOLUTE
Molecular Formula C7H10O7
Molecular Weight 206.1501
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HOMOCITRIC ACID, (R)-

SMILES

OC(=O)CC[C@@](O)(CC(O)=O)C(O)=O

InChI

InChIKey=XKJVEVRQMLKSMO-SSDOTTSWSA-N
InChI=1S/C7H10O7/c8-4(9)1-2-7(14,6(12)13)3-5(10)11/h14H,1-3H2,(H,8,9)(H,10,11)(H,12,13)/t7-/m1/s1

HIDE SMILES / InChI

Molecular Formula C7H10O7
Molecular Weight 206.1501
Charge 0
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 15:19:04 GMT 2023
Edited
by admin
on Sat Dec 16 15:19:04 GMT 2023
Record UNII
ZKT4VU34U6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HOMOCITRIC ACID, (R)-
Common Name English
1,2,4-BUTANETRICARBOXYLIC ACID, 2-HYDROXY-, (2R)-
Systematic Name English
1,2,4-BUTANETRICARBOXYLIC ACID, 2-HYDROXY-, (R)-(-)-
Systematic Name English
(2R)-2-HYDROXY-1,2,4-BUTANETRICARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
CAS
13052-73-8
Created by admin on Sat Dec 16 15:19:04 GMT 2023 , Edited by admin on Sat Dec 16 15:19:04 GMT 2023
PRIMARY
EPA CompTox
DTXSID60863193
Created by admin on Sat Dec 16 15:19:04 GMT 2023 , Edited by admin on Sat Dec 16 15:19:04 GMT 2023
PRIMARY
PUBCHEM
439459
Created by admin on Sat Dec 16 15:19:04 GMT 2023 , Edited by admin on Sat Dec 16 15:19:04 GMT 2023
PRIMARY
FDA UNII
ZKT4VU34U6
Created by admin on Sat Dec 16 15:19:04 GMT 2023 , Edited by admin on Sat Dec 16 15:19:04 GMT 2023
PRIMARY
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