DIGITOPURPONE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H10O5
Molecular Weight	270.2369
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DIGITOPURPONE

Structure Search

SMILES

CC1=CC(O)=C2C(=O)C3=C(C(O)=CC=C3)C(=O)C2=C1O

InChI

InChIKey=PCXFOXVKFKRJSN-UHFFFAOYSA-N

InChI=1S/C15H10O5/c1-6-5-9(17)11-12(13(6)18)15(20)10-7(14(11)19)3-2-4-8(10)16/h2-5,16-18H,1H3

HIDE SMILES / InChI

Molecular Formula	C15H10O5
Molecular Weight	270.2369
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 `Tue Apr 01 20:14:06 GMT 2025` Edited by `admin` on `Tue Apr 01 20:14:06 GMT 2025`
Record UNII	V20CXI9UG7
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-270535

Preferred Name

English

DIGITOPURPONE

Common Name

English

9,10-ANTHRACENEDIONE, 1,4,8-TRIHYDROXY-2-METHYL-

Systematic Name

English

1,4,8-TRIHYDROXY-2-METHYL-9,10-ANTHRACENEDIONE

Systematic Name

English

ANTHRAQUINONE, 1,4,8-TRIHYDROXY-2-METHYL-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID90188003

Created by admin on Tue Apr 01 20:14:06 GMT 2025 , Edited by admin on Tue Apr 01 20:14:06 GMT 2025

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NSC

270535

Created by admin on Tue Apr 01 20:14:06 GMT 2025 , Edited by admin on Tue Apr 01 20:14:06 GMT 2025

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PUBCHEM

100242

Created by admin on Tue Apr 01 20:14:06 GMT 2025 , Edited by admin on Tue Apr 01 20:14:06 GMT 2025

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CAS

34425-57-5

Created by admin on Tue Apr 01 20:14:06 GMT 2025 , Edited by admin on Tue Apr 01 20:14:06 GMT 2025

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FDA UNII

V20CXI9UG7

Created by admin on Tue Apr 01 20:14:06 GMT 2025 , Edited by admin on Tue Apr 01 20:14:06 GMT 2025

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