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(S)-atrolactic acid

PropertiesImage
MNX_IDMNXM31781 Image of MNXM31781
referencechebi:40741
formulaC9H10O3
global charge0
mol weight166.176
InChIKeyNWCHELUCVWSRRS-VIFPVBQESA-N
InChIInChI=1S/C9H10O3/c1-9(12,8(10)11)7-5-3-2-4-6-7/h2-6,12H,1H3,(H,10,11)/t9-/m0/s1
SMILESC[C@@](O)(C(=O)O)C1=CC=CC=C1
MNX internals
InChI (mnx)InChI=1/C9H10O3/c1-9(12,8(10)11)7-5-3-2-4-6-7/h2-6,12H,1H3,(H,10,11)/t9-/m0/s1 Image of MNXM31781
SMILES (mnx)[CH3:1][C@:9]([C:7]1=[CH:5][CH:3]=[CH:2][CH:4]=[CH:6]1)([C:8](=[O:10])[OH:11])[OH:12]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:40741
chebi:40741
NWCHELUCVWSRRS-VIFPVBQESA-N
(S)-atrolactic acid
(2S)-2-hydroxy-2-phenylpropanoic acid
(S)-ATROLACTIC ACID

CHEBI:50392
chebi:50392
NWCHELUCVWSRRS-UHFFFAOYSA-N
atrolactic acid
2-Hydroxy-2-phenylpropionic acid
2-Phenyllactic acid
2-hydroxy-2-phenylpropanoic acid
alpha-hydroxy-alpha-methylbenzeneacetic acid
alpha-hydroxy-alpha-phenylpropionic acid
alpha-methylmandelic acid

chebi:32981
chebi:40733
secondary/obsolete/fantasy identifier