N-CAFFEOYLALANINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H17NO5
Molecular Weight	327.3313
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)\C=C\C2=CC=C(O)C(O)=C2

InChI

InChIKey=QPJDGIIOGMCKTH-KGXGESDWSA-N

InChI=1S/C18H17NO5/c20-15-8-6-13(11-16(15)21)7-9-17(22)19-14(18(23)24)10-12-4-2-1-3-5-12/h1-9,11,14,20-21H,10H2,(H,19,22)(H,23,24)/b9-7+/t14-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C18H17NO5
Molecular Weight	327.3313
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 16:20:50 GMT 2025` Edited by `admin` on `Tue Apr 01 16:20:50 GMT 2025`
Record UNII	C7G6G5T5J7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

L-PHENYLALANINE, N-(3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPENYL)-, (E)-

Preferred Name

English

N-CAFFEOYLALANINE

Common Name

English

N-(E)-CAFFEOYL-L-PHENYLALANINE

Common Name

English

L-PHENYLALANINE, N-((2E)-3-(3,4-DIHYDROXYPHENYL)-1-OXO-2-PROPEN-1-YL)-

Systematic Name

English

N-CAFFEOYL-PHENYLALANINE

Common Name

English

(2S)-2-((2E)-3-(3,4-DIHYDROXYPHENYL)PROP-2-ENAMIDO)-3-PHENYLPROPANOIC ACID

Systematic Name

English

Code System Code Type Description

PUBCHEM

15228041

Created by admin on Tue Apr 01 16:20:50 GMT 2025 , Edited by admin on Tue Apr 01 16:20:50 GMT 2025

PRIMARY

CAS

170663-16-8

Created by admin on Tue Apr 01 16:20:50 GMT 2025 , Edited by admin on Tue Apr 01 16:20:50 GMT 2025

PRIMARY

FDA UNII

C7G6G5T5J7

Created by admin on Tue Apr 01 16:20:50 GMT 2025 , Edited by admin on Tue Apr 01 16:20:50 GMT 2025

PRIMARY

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