1,3,6,7,8,10,11,12-Octahydrobenzo[e]pyren-9(2H)-one

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H20O
Molecular Weight	276.3722
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,3,6,7,8,10,11,12-Octahydrobenzo[e]pyren-9(2H)-one

Structure Search

SMILES

O=C1CCCC2=C1C3=C4C(CCC3)=CC=C5CCCC2=C45

InChI

InChIKey=UIJOUFUKJPLQEK-UHFFFAOYSA-N

InChI=1S/C20H20O/c21-17-9-3-7-15-14-6-1-4-12-10-11-13-5-2-8-16(20(15)17)19(13)18(12)14/h10-11H,1-9H2

HIDE SMILES / InChI

Molecular Formula	C20H20O
Molecular Weight	276.3722
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 19:17:12 GMT 2025` Edited by `admin` on `Tue Apr 01 19:17:12 GMT 2025`
Record UNII	5HKW82AUN3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,3,6,7,8,10,11,12-Octahydrobenzo[e]pyren-9(2H)-one

Systematic Name

English

Benzo[e]pyren-9(2H)-one, 1,3,6,7,8,10,11,12-octahydro-

Preferred Name

English

Code System Code Type Description

FDA UNII

5HKW82AUN3

Created by admin on Tue Apr 01 19:17:12 GMT 2025 , Edited by admin on Tue Apr 01 19:17:12 GMT 2025

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CAS

68151-08-6

Created by admin on Tue Apr 01 19:17:12 GMT 2025 , Edited by admin on Tue Apr 01 19:17:12 GMT 2025

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PUBCHEM

155017

Created by admin on Tue Apr 01 19:17:12 GMT 2025 , Edited by admin on Tue Apr 01 19:17:12 GMT 2025

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EPA CompTox

DTXSID80218328

Created by admin on Tue Apr 01 19:17:12 GMT 2025 , Edited by admin on Tue Apr 01 19:17:12 GMT 2025

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ECHA (EC/EINECS)

268-853-3

Created by admin on Tue Apr 01 19:17:12 GMT 2025 , Edited by admin on Tue Apr 01 19:17:12 GMT 2025

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