4-(((2-((6-((AMINOIMINOMETHYL)AMINO)HEXYL)AMINO)-2-OXOETHOXY)CARBONYL)AMINO)BUTANOIC ACID

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H27N5O5
Molecular Weight	345.3947
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(((2-((6-((AMINOIMINOMETHYL)AMINO)HEXYL)AMINO)-2-OXOETHOXY)CARBONYL)AMINO)BUTANOIC ACID

Structure Search

SMILES

NC(=N)NCCCCCCNC(=O)COC(=O)NCCCC(O)=O

InChI

InChIKey=PCQPKENXEOVCBX-UHFFFAOYSA-N

InChI=1S/C14H27N5O5/c15-13(16)18-8-4-2-1-3-7-17-11(20)10-24-14(23)19-9-5-6-12(21)22/h1-10H2,(H,17,20)(H,19,23)(H,21,22)(H4,15,16,18)

HIDE SMILES / InChI

Molecular Formula	C14H27N5O5
Molecular Weight	345.3947
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 16:42:04 GMT 2023` Edited by `admin` on `Sat Dec 16 16:42:04 GMT 2023`
Record UNII	GKP8O95XQM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-(((2-((6-((AMINOIMINOMETHYL)AMINO)HEXYL)AMINO)-2-OXOETHOXY)CARBONYL)AMINO)BUTANOIC ACID

Systematic Name

English

12-OXA-2,9,14-TRIAZAOCTADECAN-18-OIC ACID, 1-AMINO-1-IMINO-10,13-DIOXO-

Systematic Name

English

TRESPERIMUS METABOLITE M5

Common Name

English

BUTANOIC ACID, 4-(((2-((6-((AMINOIMINOMETHYL)AMINO)HEXYL)AMINO)-2-OXOETHOXY)CARBONYL)AMINO)-

Systematic Name

English

Code System Code Type Description

CAS

351197-40-5

Created by admin on Sat Dec 16 16:42:05 GMT 2023 , Edited by admin on Sat Dec 16 16:42:05 GMT 2023

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FDA UNII

GKP8O95XQM

Created by admin on Sat Dec 16 16:42:05 GMT 2023 , Edited by admin on Sat Dec 16 16:42:05 GMT 2023

PRIMARY

PUBCHEM

154731636

Created by admin on Sat Dec 16 16:42:05 GMT 2023 , Edited by admin on Sat Dec 16 16:42:05 GMT 2023

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Related Record Type Details


					286F595V8H

TRESPERIMUS

PARENT -> METABOLITE

Qualification:

PLASMA

Amount: