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Details

Stereochemistry RACEMIC
Molecular Formula C9H10O3
Molecular Weight 166.1739
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ATROLACTIC ACID

SMILES

CC(O)(C(O)=O)C1=CC=CC=C1

InChI

InChIKey=NWCHELUCVWSRRS-UHFFFAOYSA-N
InChI=1S/C9H10O3/c1-9(12,8(10)11)7-5-3-2-4-6-7/h2-6,12H,1H3,(H,10,11)

HIDE SMILES / InChI

Molecular Formula C9H10O3
Molecular Weight 166.1739
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Perturbing the hydrophobic pocket of mandelate racemase to probe phenyl motion during catalysis.
2005 Jun 28
Substance Class Chemical
Created
by admin
on Sat Dec 16 10:09:25 GMT 2023
Edited
by admin
on Sat Dec 16 10:09:25 GMT 2023
Record UNII
3709C1T8IF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ATROLACTIC ACID
MI  
Common Name English
NSC-401846
Code English
DL-.ALPHA.-PHENYLLACTIC ACID
Common Name English
NSC-128998
Code English
ATROLACTIC ACID ANHYDROUS
Common Name English
(±)-2-PHENYLLACTIC ACID
Systematic Name English
DL-.ALPHA.-METHYLMANDELIC ACID
Common Name English
ATROLACTIC ACID DL-FORM
Common Name English
ATROLACTIC ACID, (±)-
Common Name English
ATROLACTINIC ACID
Common Name English
BENZENEACETIC ACID, .ALPHA.-HYDROXY-.ALPHA.-METHYL-
Common Name English
ATROLACTIC ACID [MI]
Common Name English
(±)-2-HYDROXY-2-PHENYLPROPIONIC ACID
Systematic Name English
Code System Code Type Description
CAS
515-30-0
Created by admin on Sat Dec 16 10:09:25 GMT 2023 , Edited by admin on Sat Dec 16 10:09:25 GMT 2023
PRIMARY
FDA UNII
3709C1T8IF
Created by admin on Sat Dec 16 10:09:25 GMT 2023 , Edited by admin on Sat Dec 16 10:09:25 GMT 2023
PRIMARY
NSC
128998
Created by admin on Sat Dec 16 10:09:25 GMT 2023 , Edited by admin on Sat Dec 16 10:09:25 GMT 2023
PRIMARY
NSC
401846
Created by admin on Sat Dec 16 10:09:25 GMT 2023 , Edited by admin on Sat Dec 16 10:09:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID10862090
Created by admin on Sat Dec 16 10:09:25 GMT 2023 , Edited by admin on Sat Dec 16 10:09:25 GMT 2023
PRIMARY
PUBCHEM
1303
Created by admin on Sat Dec 16 10:09:25 GMT 2023 , Edited by admin on Sat Dec 16 10:09:25 GMT 2023
PRIMARY
ECHA (EC/EINECS)
208-196-1
Created by admin on Sat Dec 16 10:09:25 GMT 2023 , Edited by admin on Sat Dec 16 10:09:25 GMT 2023
PRIMARY
MERCK INDEX
m2134
Created by admin on Sat Dec 16 10:09:25 GMT 2023 , Edited by admin on Sat Dec 16 10:09:25 GMT 2023
PRIMARY Merck Index
Related Record Type Details
SOLVATE->ANHYDROUS