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Details

Stereochemistry RACEMIC
Molecular Formula C7H10O7
Molecular Weight 206.1501
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-METHYLISOCITRIC ACID, THREO-

SMILES

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

InChI

InChIKey=HHKPKXCSHMJWCF-NOWQDGDBSA-N
InChI=1S/C7H10O7/c1-7(14,6(12)13)3(5(10)11)2-4(8)9/h3,14H,2H2,1H3,(H,8,9)(H,10,11)(H,12,13)/t3-,7-/m0/s1

HIDE SMILES / InChI

Molecular Formula C7H10O7
Molecular Weight 206.1501
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:10:22 GMT 2023
Edited
by admin
on Sat Dec 16 12:10:22 GMT 2023
Record UNII
ZC5YS92LCE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.ALPHA.-METHYLISOCITRIC ACID, THREO-
Common Name English
DL-THREO-PENTARIC ACID, 3-CARBOXY-2,3-DIDEOXY-4-C-METHY
Systematic Name English
THREO-PENTARIC ACID, 3-CARBOXY-2,3-DIDEOXY-4-C-METHYL-
Systematic Name English
.ALPHA.-METHYLISOCITRIC ACID, (THREO-DL)-
Systematic Name English
Code System Code Type Description
FDA UNII
ZC5YS92LCE
Created by admin on Sat Dec 16 12:10:22 GMT 2023 , Edited by admin on Sat Dec 16 12:10:22 GMT 2023
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PUBCHEM
46936880
Created by admin on Sat Dec 16 12:10:22 GMT 2023 , Edited by admin on Sat Dec 16 12:10:22 GMT 2023
PRIMARY