N-PERFLUOROPELARGONOYLDOPAMINE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H10F17NO3
Molecular Weight	599.2391
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-PERFLUOROPELARGONOYLDOPAMINE

Structure Search

SMILES

OC1=CC=C(CCNC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C=C1O

InChI

InChIKey=KBXCDKNSADMWLR-UHFFFAOYSA-N

InChI=1S/C17H10F17NO3/c18-10(19,9(38)35-4-3-6-1-2-7(36)8(37)5-6)11(20,21)12(22,23)13(24,25)14(26,27)15(28,29)16(30,31)17(32,33)34/h1-2,5,36-37H,3-4H2,(H,35,38)

HIDE SMILES / InChI

Molecular Formula	C17H10F17NO3
Molecular Weight	599.2391
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 `Sat Dec 16 10:05:35 UTC 2023` Edited by `admin` on `Sat Dec 16 10:05:35 UTC 2023`
Record UNII	OQV246BA28
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-PERFLUOROPELARGONOYLDOPAMINE

Common Name

English

NONANAMIDE, N-(2-(3,4-DIHYDROXYPHENYL)ETHYL)-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-HEPTADECAFLUORO-

Systematic Name

English

Code System Code Type Description

PUBCHEM

73425498

Created by admin on Sat Dec 16 10:05:35 UTC 2023 , Edited by admin on Sat Dec 16 10:05:35 UTC 2023

PRIMARY

FDA UNII

OQV246BA28

Created by admin on Sat Dec 16 10:05:35 UTC 2023 , Edited by admin on Sat Dec 16 10:05:35 UTC 2023

PRIMARY

EPA CompTox

DTXSID301021606

Created by admin on Sat Dec 16 10:05:35 UTC 2023 , Edited by admin on Sat Dec 16 10:05:35 UTC 2023

PRIMARY

CAS

105988-39-4

Created by admin on Sat Dec 16 10:05:35 UTC 2023 , Edited by admin on Sat Dec 16 10:05:35 UTC 2023

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Related Record Type Details


					0PDN17832A

IPOMOEA AQUATICA LEAF

PARENT -> CONSTITUENT ALWAYS PRESENT

Comments:

66 nM IC50 vs arachidonate 5-lipoxygenase