XANTHOHUMOL

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H22O5
Molecular Weight	354.3964
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of XANTHOHUMOL

Structure Search

SMILES

COC1=C(C(=O)\C=C\C2=CC=C(O)C=C2)C(O)=C(CC=C(C)C)C(O)=C1

InChI

InChIKey=ORXQGKIUCDPEAJ-YRNVUSSQSA-N

InChI=1S/C21H22O5/c1-13(2)4-10-16-18(24)12-19(26-3)20(21(16)25)17(23)11-7-14-5-8-15(22)9-6-14/h4-9,11-12,22,24-25H,10H2,1-3H3/b11-7+

HIDE SMILES / InChI

Molecular Formula	C21H22O5
Molecular Weight	354.3964
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:59:00 UTC 2023` Edited by `admin` on `Fri Dec 15 18:59:00 UTC 2023`
Record UNII	T4467YT1NT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

XANTHOHUMOL

Official Name

English

XANTHO-FLAV

Brand Name

English

XANTHOHUMOL [INCI]

Common Name

English

(2E)-1-(2,4-DIHYDROXY-6-METHOXY-3-(3-METHYL-2-BUTEN-1-YL)PHENYL)-3-(4-HYDROXYPHENYL)-2-PROPEN-1-ONE

Systematic Name

English

(E)-1-(2,4-DIHYDROXY-6-METHOXY-3-(3-METHYLBUT-2-ENYL)PHENYL)-3-(4-HYDROXYPHENYL)PROP-2-EN-1-ONE

Systematic Name

English

2-PROPEN-1-ONE, 1-(2,4-HYDROXY-6-METHOXY-3-(3-METHYL-2-BUTENYL)PHENYL)-3-(4-HYDROXYPHENYL)-, (E)-

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C274

Created by admin on Fri Dec 15 18:59:00 UTC 2023 , Edited by admin on Fri Dec 15 18:59:00 UTC 2023

DSLD

3469 (Number of products:3)

Created by admin on Fri Dec 15 18:59:00 UTC 2023 , Edited by admin on Fri Dec 15 18:59:00 UTC 2023

Code System Code Type Description

PUBCHEM

639665

Created by admin on Fri Dec 15 18:59:00 UTC 2023 , Edited by admin on Fri Dec 15 18:59:00 UTC 2023

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DRUG BANK

DB15359

Created by admin on Fri Dec 15 18:59:00 UTC 2023 , Edited by admin on Fri Dec 15 18:59:00 UTC 2023

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WIKIPEDIA

XANTHOHUMOL

Created by admin on Fri Dec 15 18:59:00 UTC 2023 , Edited by admin on Fri Dec 15 18:59:00 UTC 2023

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NCI_THESAURUS

C121950

Created by admin on Fri Dec 15 18:59:00 UTC 2023 , Edited by admin on Fri Dec 15 18:59:00 UTC 2023

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CAS

6754-58-1

Created by admin on Fri Dec 15 18:59:00 UTC 2023 , Edited by admin on Fri Dec 15 18:59:00 UTC 2023

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FDA UNII

T4467YT1NT

Created by admin on Fri Dec 15 18:59:00 UTC 2023 , Edited by admin on Fri Dec 15 18:59:00 UTC 2023

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CHEBI

134289

Created by admin on Fri Dec 15 18:59:00 UTC 2023 , Edited by admin on Fri Dec 15 18:59:00 UTC 2023

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EPA CompTox

DTXSID00893171

Created by admin on Fri Dec 15 18:59:00 UTC 2023 , Edited by admin on Fri Dec 15 18:59:00 UTC 2023

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MESH

C104536

Created by admin on Fri Dec 15 18:59:00 UTC 2023 , Edited by admin on Fri Dec 15 18:59:00 UTC 2023

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