2-METHYLHEPTADECANOIC ACID

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C18H36O2
Molecular Weight	284.4772
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-METHYLHEPTADECANOIC ACID

Structure Search

SMILES

CCCCCCCCCCCCCCCC(C)C(O)=O

InChI

InChIKey=IZUAKSAWRVFBPE-UHFFFAOYSA-N

InChI=1S/C18H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(2)18(19)20/h17H,3-16H2,1-2H3,(H,19,20)

HIDE SMILES / InChI

Molecular Formula	C18H36O2
Molecular Weight	284.4772
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

PubMed

PubMed

Title	Date	PubMed
An inverse relationship between ceramide synthesis and clinical severity in patients with psoriasis.	2004 Dec	15608398

Substance Class	Chemical Created by `admin` on `Fri Dec 15 22:46:31 GMT 2023` Edited by `admin` on `Fri Dec 15 22:46:31 GMT 2023`
Record UNII	USO2AQ1J3Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-METHYLHEPTADECANOIC ACID

Systematic Name

English

.LAMBDA.-ISOSTEARIC ACID

Common Name

English

HEPTADECANOIC ACID, 2-METHYL-

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID50884175

Created by admin on Fri Dec 15 22:46:31 GMT 2023 , Edited by admin on Fri Dec 15 22:46:31 GMT 2023

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CAS

5638-12-0

Created by admin on Fri Dec 15 22:46:31 GMT 2023 , Edited by admin on Fri Dec 15 22:46:31 GMT 2023

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PUBCHEM

5282646

Created by admin on Fri Dec 15 22:46:31 GMT 2023 , Edited by admin on Fri Dec 15 22:46:31 GMT 2023

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ECHA (EC/EINECS)

227-085-9

Created by admin on Fri Dec 15 22:46:31 GMT 2023 , Edited by admin on Fri Dec 15 22:46:31 GMT 2023

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FDA UNII

USO2AQ1J3Z

Created by admin on Fri Dec 15 22:46:31 GMT 2023 , Edited by admin on Fri Dec 15 22:46:31 GMT 2023

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