10-HYDROXYBENZO(A)PYRENE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H12O
Molecular Weight	268.3087
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC1=C2C(=CC=C1)C=C3C=CC4=C5C(C=CC2=C35)=CC=C4

InChI

InChIKey=ANHMWNGBSJFXSA-UHFFFAOYSA-N

InChI=1S/C20H12O/c21-17-6-2-5-14-11-15-8-7-12-3-1-4-13-9-10-16(19(14)17)20(15)18(12)13/h1-11,21H

HIDE SMILES / InChI

Molecular Formula	C20H12O
Molecular Weight	268.3087
Charge	0
Count

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

Approval Year

PubMed

Title	Date	PubMed
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.	2006-11	16497524

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:24:36 GMT 2025` Edited by `admin` on `Mon Mar 31 19:24:36 GMT 2025`
Record UNII	7F2SW447RI
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

10-HYDROXY BENZO(A)PYRENE

Preferred Name

English

10-HYDROXYBENZO(A)PYRENE

Systematic Name

English

BENZO(A)PYREN-10-OL

Systematic Name

English

BENZO(A)PYRENE, 10-HYDROXY-

Systematic Name

English

HYDROXYBENZO(A)PYRENE, 10-

Systematic Name

English

BENZO(PQR)TETRAPHEN-10-OL

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID40205416

Created by admin on Mon Mar 31 19:24:36 GMT 2025 , Edited by admin on Mon Mar 31 19:24:36 GMT 2025

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PUBCHEM

42028

Created by admin on Mon Mar 31 19:24:36 GMT 2025 , Edited by admin on Mon Mar 31 19:24:36 GMT 2025

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FDA UNII

7F2SW447RI

Created by admin on Mon Mar 31 19:24:36 GMT 2025 , Edited by admin on Mon Mar 31 19:24:36 GMT 2025

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CAS

56892-31-0

Created by admin on Mon Mar 31 19:24:36 GMT 2025 , Edited by admin on Mon Mar 31 19:24:36 GMT 2025

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