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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H26O11
Molecular Weight 514.478
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of DEMETHOXYCURCUMIN GLUCURONIDE

SMILES

COC1=CC(\C=C\C(=O)CC(=O)\C=C\C2=CC=C(O)C=C2)=CC=C1O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O

InChI

InChIKey=YWKJMTRJZNWNFX-RMUOXEHGSA-N
InChI=1S/C26H26O11/c1-35-20-12-15(5-10-18(29)13-17(28)9-4-14-2-7-16(27)8-3-14)6-11-19(20)36-26-23(32)21(30)22(31)24(37-26)25(33)34/h2-12,21-24,26-27,30-32H,13H2,1H3,(H,33,34)/b9-4+,10-5+/t21-,22-,23+,24-,26+/m0/s1

HIDE SMILES / InChI

Molecular Formula C26H26O11
Molecular Weight 514.478
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:08:19 GMT 2023
Edited
by admin
on Sat Dec 16 11:08:19 GMT 2023
Record UNII
S702I6I4FQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEMETHOXYCURCUMIN GLUCURONIDE
Common Name English
(2S,3S,4S,5R,6S)-3,4,5-TRIHYDROXY-6-(4-((1E,6E)-5-HYDROXY-7-(4-HYDROXYPHENYL)-3-OXOHEPTA-1,6-DIEN-1-YL)-2-METHOXYPHENOXY)TETRAHYDRO-2H-PYRAN-2-CARBOXYLIC ACID
Systematic Name English
DESMETHOXYCURCUMIN GLUCURONIDE
Common Name English
Code System Code Type Description
PUBCHEM
90478404
Created by admin on Sat Dec 16 11:08:20 GMT 2023 , Edited by admin on Sat Dec 16 11:08:20 GMT 2023
PRIMARY
FDA UNII
S702I6I4FQ
Created by admin on Sat Dec 16 11:08:20 GMT 2023 , Edited by admin on Sat Dec 16 11:08:20 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE