1-DOTRIACONTENE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C32H64
Molecular Weight	448.8506
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-DOTRIACONTENE

Structure Search

SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=C

InChI

InChIKey=WMRDPJYQERQCEP-UHFFFAOYSA-N

InChI=1S/C32H64/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3H,1,4-32H2,2H3

HIDE SMILES / InChI

Molecular Formula	C32H64
Molecular Weight	448.8506
Charge	0
Count

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

Approval Year

PubMed

PubMed

Title	Date	PubMed
A new long-chain alkene and antituberculosis constituents from the leaves of Pourthiaea lucida.	2010 Mar	20232337

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:00:36 GMT 2023` Edited by `admin` on `Fri Dec 15 18:00:36 GMT 2023`
Record UNII	1XV928K1PM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-DOTRIACONTENE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID60171563

Created by admin on Fri Dec 15 18:00:36 GMT 2023 , Edited by admin on Fri Dec 15 18:00:36 GMT 2023

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FDA UNII

1XV928K1PM

Created by admin on Fri Dec 15 18:00:36 GMT 2023 , Edited by admin on Fri Dec 15 18:00:36 GMT 2023

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ECHA (EC/EINECS)

242-315-8

Created by admin on Fri Dec 15 18:00:36 GMT 2023 , Edited by admin on Fri Dec 15 18:00:36 GMT 2023

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CAS

18435-55-7

Created by admin on Fri Dec 15 18:00:36 GMT 2023 , Edited by admin on Fri Dec 15 18:00:36 GMT 2023

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PUBCHEM

87640

Created by admin on Fri Dec 15 18:00:36 GMT 2023 , Edited by admin on Fri Dec 15 18:00:36 GMT 2023

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