ISOGENTISIN

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H10O5
Molecular Weight	258.2262
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ISOGENTISIN

Structure Search

SMILES

COC1=CC2=C(OC3=C(C2=O)C(O)=CC(O)=C3)C=C1

InChI

InChIKey=FVIYCYAHKMJVJK-UHFFFAOYSA-N

InChI=1S/C14H10O5/c1-18-8-2-3-11-9(6-8)14(17)13-10(16)4-7(15)5-12(13)19-11/h2-6,15-16H,1H3

HIDE SMILES / InChI

Molecular Formula	C14H10O5
Molecular Weight	258.2262
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:52:41 GMT 2025` Edited by `admin` on `Mon Mar 31 21:52:41 GMT 2025`
Record UNII	JPC53Q6QYC
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ISOGENTISINE

Preferred Name

English

ISOGENTISIN

Common Name

English

1,3-DIHYDROXY-7-METHOXYXANTHEN-9-ONE

Systematic Name

English

1,3-DIHYDROXY-7-METHOXY-9H-XANTHEN-9-ONE

Systematic Name

English

9H-XANTHEN-9-ONE, 1,3-DIHYDROXY-7-METHOXY-

Systematic Name

English

Code System Code Type Description

CAS

491-64-5

Created by admin on Mon Mar 31 21:52:41 GMT 2025 , Edited by admin on Mon Mar 31 21:52:41 GMT 2025

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EPA CompTox

DTXSID00197686

Created by admin on Mon Mar 31 21:52:41 GMT 2025 , Edited by admin on Mon Mar 31 21:52:41 GMT 2025

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FDA UNII

JPC53Q6QYC

Created by admin on Mon Mar 31 21:52:41 GMT 2025 , Edited by admin on Mon Mar 31 21:52:41 GMT 2025

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PUBCHEM

5281640

Created by admin on Mon Mar 31 21:52:41 GMT 2025 , Edited by admin on Mon Mar 31 21:52:41 GMT 2025

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CHEBI

6017

Created by admin on Mon Mar 31 21:52:41 GMT 2025 , Edited by admin on Mon Mar 31 21:52:41 GMT 2025

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