HEXAHYDROCURCUMIN .BETA.-O-GLUCURONIDE

Details

Stereochemistry	MIXED
Molecular Formula	C27H34O12
Molecular Weight	550.5517
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of HEXAHYDROCURCUMIN .BETA.-O-GLUCURONIDE

Structure Search

SMILES

COC1=CC(CCC(O)CC(=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=HYPGOIVJCQYOQR-USZYGUOMSA-N

InChI=1S/C27H34O12/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/h5-6,9-12,16,22-25,27-28,30-33H,3-4,7-8,13H2,1-2H3,(H,34,35)/t16?,22-,23-,24+,25-,27+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C27H34O12
Molecular Weight	550.5517
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	5 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:14:00 GMT 2023` Edited by `admin` on `Sat Dec 16 11:14:00 GMT 2023`
Record UNII	7K3QWL7KXP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

HEXAHYDROCURCUMIN .BETA.-O-GLUCURONIDE

Common Name

English

(2S,3S,4S,5R,6S)-3,4,5-TRIHYDROXY-6-(4-(5-HYDROXY-7-(4-HYDROXY-3-METHOXYPHENYL)-3-OXOHEPTYL)-2-METHOXYPHENOXY)OXANE-2-CARBOXYLIC ACID

Systematic Name

English

HEXAHYDROCURCUMIN GLUCURONOSIDE

Common Name

English

(2S,3S,4S,5R,6S)-3,4,5-TRIHYDROXY-6-(4-(5-HYDROXY-7-(4-HYDROXY-3-METHOXYPHENYL)-3-OXOHEPTYL)-2-METHOXYPHENOXY)TETRAHYDRO-2H-PYRAN-2-CARBOXYLIC ACID

Systematic Name

English

Code System Code Type Description

FDA UNII

7K3QWL7KXP

Created by admin on Sat Dec 16 11:14:00 GMT 2023 , Edited by admin on Sat Dec 16 11:14:00 GMT 2023

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PUBCHEM

24968347

Created by admin on Sat Dec 16 11:14:00 GMT 2023 , Edited by admin on Sat Dec 16 11:14:00 GMT 2023

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