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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H12O5
Molecular Weight 224.21
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (-)-5-(3',4',5'-TRIHYDROXYPHENYL)-.GAMMA.-VALEROLACTONE

SMILES

OC1=CC(C[C@H]2CCC(=O)O2)=CC(O)=C1O

InChI

InChIKey=CZVAQLJEUUFQCH-SSDOTTSWSA-N
InChI=1S/C11H12O5/c12-8-4-6(5-9(13)11(8)15)3-7-1-2-10(14)16-7/h4-5,7,12-13,15H,1-3H2/t7-/m1/s1

HIDE SMILES / InChI

Molecular Formula C11H12O5
Molecular Weight 224.21
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 Thu Jul 06 23:39:17 UTC 2023
Edited
by admin
on Thu Jul 06 23:39:17 UTC 2023
Record UNII
YF6NGF5J3S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(-)-5-(3',4',5'-TRIHYDROXYPHENYL)-.GAMMA.-VALEROLACTONE
Common Name English
EPIGALLOCATECHIN GALLATE METABOLITE M4
Common Name English
5-(3',4',5'-TRIHYDROXYPHENYL)-.GAMMA.-VALEROLACTONE
Common Name English
2(3H)-FURANONE, DIHYDRO-5-((3,4,5-TRIHYDROXYPHENYL)METHYL)-, (5R)-
Systematic Name English
(R)-5-(3,4,5-TRIHYDROXYBENZYL)DIHYDROFURAN-2(3H)-ONE
Systematic Name English
EPIGALLOCATECHIN METABOLITE M4
Code English
3',4',5'-TRIHYDROXYPHENYL-.GAMMA.-VALEROLACTONE
Common Name English
Code System Code Type Description
FDA UNII
YF6NGF5J3S
Created by admin on Thu Jul 06 23:39:17 UTC 2023 , Edited by admin on Thu Jul 06 23:39:17 UTC 2023
PRIMARY
CAS
264277-86-3
Created by admin on Thu Jul 06 23:39:17 UTC 2023 , Edited by admin on Thu Jul 06 23:39:17 UTC 2023
PRIMARY
PUBCHEM
92850118
Created by admin on Thu Jul 06 23:39:17 UTC 2023 , Edited by admin on Thu Jul 06 23:39:17 UTC 2023
PRIMARY
Related Record Type Details
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