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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H32O12
Molecular Weight 548.5358
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of TETRAHYDROCURCUMIN .BETA.-O-GLUCURONIDE

SMILES

COC1=CC(CC\C(O)=C\C(=O)CCC2=CC(OC)=C(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)C=C2)=CC=C1O

InChI

InChIKey=NJXVQZJOUDIWTN-DPYRWGAKSA-N
InChI=1S/C27H32O12/c1-36-20-11-14(5-9-18(20)30)3-7-16(28)13-17(29)8-4-15-6-10-19(21(12-15)37-2)38-27-24(33)22(31)23(32)25(39-27)26(34)35/h5-6,9-13,22-25,27-28,30-33H,3-4,7-8H2,1-2H3,(H,34,35)/b16-13-/t22-,23-,24+,25-,27+/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H32O12
Molecular Weight 548.5358
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:44:57 GMT 2023
Edited
by admin
on Sat Dec 16 08:44:57 GMT 2023
Record UNII
FA26VP94XR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TETRAHYDROCURCUMIN .BETA.-O-GLUCURONIDE
Common Name English
TETRAHYDROCURCUMIN MONOGLUCURONIDE
Common Name English
.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 4-(7-(4-HYDROXY-3-METHOXYPHENYL)-3,5-DIOXOHEPTYL)-2-METHOXYPHENYL
Common Name English
TETRAHYDROCURCUMIN GLUCURONOSIDE
Common Name English
(2S,3S,4S,5R,6S)-3,4,5-TRIHYDROXY-6-(4-((Z)-5-HYDROXY-7-(4-HYDROXY-3-METHOXYPHENYL)-3-OXOHEPT-4-EN-1-YL)-2-METHOXYPHENOXY)TETRAHYDRO-2H-PYRAN-2-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID901025749
Created by admin on Sat Dec 16 08:44:57 GMT 2023 , Edited by admin on Sat Dec 16 08:44:57 GMT 2023
PRIMARY
FDA UNII
FA26VP94XR
Created by admin on Sat Dec 16 08:44:57 GMT 2023 , Edited by admin on Sat Dec 16 08:44:57 GMT 2023
PRIMARY
CAS
227466-74-2
Created by admin on Sat Dec 16 08:44:57 GMT 2023 , Edited by admin on Sat Dec 16 08:44:57 GMT 2023
PRIMARY
Related Record Type Details
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