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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H24O10
Molecular Weight 436.4093
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRILOBATIN

SMILES

OC[C@H]1O[C@@H](OC2=CC(O)=C(C(=O)CCC3=CC=C(O)C=C3)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O

InChI

InChIKey=GSTCPEBQYSOEHV-QNDFHXLGSA-N
InChI=1S/C21H24O10/c22-9-16-18(27)19(28)20(29)21(31-16)30-12-7-14(25)17(15(26)8-12)13(24)6-3-10-1-4-11(23)5-2-10/h1-2,4-5,7-8,16,18-23,25-29H,3,6,9H2/t16-,18-,19+,20-,21-/m1/s1

HIDE SMILES / InChI

Molecular Formula C21H24O10
Molecular Weight 436.4093
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 01:11:07 UTC 2023
Edited
by admin
on Thu Jul 06 01:11:07 UTC 2023
Record UNII
23298I791N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRILOBATIN
Common Name English
P-PHLORIZIN
Common Name English
PRUNIN DIHYDROCHALCONE
Common Name English
PHLORIZIN, P-
Common Name English
1-PROPANONE, 1-(4-(.BETA.-D-GLUCOPYRANOSYLOXY)-2,6-DIHYDROXYPHENYL)-3-(4-HYDROXYPHENYL)-
Common Name English
PHLORETIN 4'-.BETA.-D-GLUCOSIDE
Common Name English
FEMA NO. 4674
Code English
Classification Tree Code System Code
JECFA EVALUATION TRILOBATIN
Created by admin on Thu Jul 06 01:11:07 UTC 2023 , Edited by admin on Thu Jul 06 01:11:07 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID10194681
Created by admin on Thu Jul 06 01:11:07 UTC 2023 , Edited by admin on Thu Jul 06 01:11:07 UTC 2023
PRIMARY
CAS
4192-90-9
Created by admin on Thu Jul 06 01:11:07 UTC 2023 , Edited by admin on Thu Jul 06 01:11:07 UTC 2023
PRIMARY
PUBCHEM
6451798
Created by admin on Thu Jul 06 01:11:07 UTC 2023 , Edited by admin on Thu Jul 06 01:11:07 UTC 2023
PRIMARY
FDA UNII
23298I791N
Created by admin on Thu Jul 06 01:11:07 UTC 2023 , Edited by admin on Thu Jul 06 01:11:07 UTC 2023
PRIMARY
CHEBI
145829
Created by admin on Thu Jul 06 01:11:07 UTC 2023 , Edited by admin on Thu Jul 06 01:11:07 UTC 2023
PRIMARY