OCTYLDODECYL PCA

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NCATS

Details

Stereochemistry	EPIMERIC
Molecular Formula	C25H47NO3
Molecular Weight	409.6456
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of OCTYLDODECYL PCA

Structure Search

SMILES

CCCCCCCCCCC(CCCCCCCC)COC(=O)[C@@H]1CCC(=O)N1

InChI

InChIKey=HQWLBRJUMWPIOA-WCSIJFPASA-N

InChI=1S/C25H47NO3/c1-3-5-7-9-11-12-14-16-18-22(17-15-13-10-8-6-4-2)21-29-25(28)23-19-20-24(27)26-23/h22-23H,3-21H2,1-2H3,(H,26,27)/t22?,23-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C25H47NO3
Molecular Weight	409.6456
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	1 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:57:20 GMT 2023` Edited by `admin` on `Sat Dec 16 11:57:20 GMT 2023`
Record UNII	E25TY46YTD
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

OCTYLDODECYL PCA

Official Name

English

2-OCTYLDODECYL 5-OXO-L-PROLINATE

Systematic Name

English

CERAMIDONE

Brand Name

English

OCTYLDODECYL PCA [INCI]

Common Name

English

L-PROLINE, 5-OXO-, 2-OCTYLDODECYL ESTER

Common Name

English

Code System Code Type Description

PUBCHEM

18654320

Created by admin on Sat Dec 16 11:57:20 GMT 2023 , Edited by admin on Sat Dec 16 11:57:20 GMT 2023

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FDA UNII

E25TY46YTD

Created by admin on Sat Dec 16 11:57:20 GMT 2023 , Edited by admin on Sat Dec 16 11:57:20 GMT 2023

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ECHA (EC/EINECS)

253-604-3

Created by admin on Sat Dec 16 11:57:20 GMT 2023 , Edited by admin on Sat Dec 16 11:57:20 GMT 2023

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EPA CompTox

DTXSID20191101

Created by admin on Sat Dec 16 11:57:20 GMT 2023 , Edited by admin on Sat Dec 16 11:57:20 GMT 2023

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DAILYMED

E25TY46YTD

Created by admin on Sat Dec 16 11:57:20 GMT 2023 , Edited by admin on Sat Dec 16 11:57:20 GMT 2023

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RXCUI

2559600

Created by admin on Sat Dec 16 11:57:20 GMT 2023 , Edited by admin on Sat Dec 16 11:57:20 GMT 2023

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CAS

37673-37-3

Created by admin on Sat Dec 16 11:57:20 GMT 2023 , Edited by admin on Sat Dec 16 11:57:20 GMT 2023

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