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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H10O4
Molecular Weight 182.1733
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0
Stereo Comments MAY READILY INTERCONVERT THROUGH AND ENOL

SHOW SMILES / InChI
Structure of (2R)-2-HYDROXY-2-(4-HYDROXY-3-METHOXY-PHENYL)ACETALDEHYDE

SMILES

COC1=C(O)C=CC(=C1)[C@@H](O)C=O

InChI

InChIKey=VISAJVAPYPFKCL-QMMMGPOBSA-N
InChI=1S/C9H10O4/c1-13-9-4-6(8(12)5-10)2-3-7(9)11/h2-5,8,11-12H,1H3/t8-/m0/s1

HIDE SMILES / InChI

Molecular Formula C9H10O4
Molecular Weight 182.1733
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 14:03:36 GMT 2023
Edited
by admin
on Sat Dec 16 14:03:36 GMT 2023
Record UNII
MFB1WL49SZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2R)-2-HYDROXY-2-(4-HYDROXY-3-METHOXY-PHENYL)ACETALDEHYDE
Systematic Name English
MANDELALDEHYDE, 4-HYDROXY-3-METHOXY-, (R)-
Common Name English
BENZENEACETALDEHYDE, .ALPHA.,4-DIHYDROXY-3-METHOXY-, (R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
90658114
Created by admin on Sat Dec 16 14:03:36 GMT 2023 , Edited by admin on Sat Dec 16 14:03:36 GMT 2023
PRIMARY
FDA UNII
MFB1WL49SZ
Created by admin on Sat Dec 16 14:03:36 GMT 2023 , Edited by admin on Sat Dec 16 14:03:36 GMT 2023
PRIMARY
EPA CompTox
DTXSID50331518
Created by admin on Sat Dec 16 14:03:36 GMT 2023 , Edited by admin on Sat Dec 16 14:03:36 GMT 2023
PRIMARY
CAS
17592-23-3
Created by admin on Sat Dec 16 14:03:36 GMT 2023 , Edited by admin on Sat Dec 16 14:03:36 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
Related Record Type Details
PARENT -> METABOLITE