3-ETHYL-CHOLANTHRENE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H18
Molecular Weight	282.3783
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-ETHYL-CHOLANTHRENE

Structure Search

SMILES

CCC1=CC=C2C=C3C(C=CC4=C3C=CC=C4)=C5CCC1=C25

InChI

InChIKey=NZZUNDKOLHKMCK-UHFFFAOYSA-N

InChI=1S/C22H18/c1-2-14-7-8-16-13-21-17-6-4-3-5-15(17)9-10-19(21)20-12-11-18(14)22(16)20/h3-10,13H,2,11-12H2,1H3

HIDE SMILES / InChI

Molecular Formula	C22H18
Molecular Weight	282.3783
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 19:45:19 GMT 2025` Edited by `admin` on `Tue Apr 01 19:45:19 GMT 2025`
Record UNII	P7C4QWA29J
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-ETHYL-CHOLANTHRENE

Systematic Name

English

NSC-30979

Preferred Name

English

Code System Code Type Description

PUBCHEM

95723

Created by admin on Tue Apr 01 19:45:19 GMT 2025 , Edited by admin on Tue Apr 01 19:45:19 GMT 2025

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EPA CompTox

DTXSID40226080

Created by admin on Tue Apr 01 19:45:19 GMT 2025 , Edited by admin on Tue Apr 01 19:45:19 GMT 2025

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FDA UNII

P7C4QWA29J

Created by admin on Tue Apr 01 19:45:19 GMT 2025 , Edited by admin on Tue Apr 01 19:45:19 GMT 2025

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NSC

30979

Created by admin on Tue Apr 01 19:45:19 GMT 2025 , Edited by admin on Tue Apr 01 19:45:19 GMT 2025

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CAS

7511-54-8

Created by admin on Tue Apr 01 19:45:19 GMT 2025 , Edited by admin on Tue Apr 01 19:45:19 GMT 2025

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