Philanthotoxin-343

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H41N5O3
Molecular Weight	435.6033
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCC(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)NCCCNCCCCNCCCN

InChI

InChIKey=DTWANULJDRVTFI-NRFANRHFSA-N

InChI=1S/C23H41N5O3/c1-2-7-22(30)28-21(18-19-8-10-20(29)11-9-19)23(31)27-17-6-16-26-14-4-3-13-25-15-5-12-24/h8-11,21,25-26,29H,2-7,12-18,24H2,1H3,(H,27,31)(H,28,30)/t21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C23H41N5O3
Molecular Weight	435.6033
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:50:18 GMT 2023` Edited by `admin` on `Sat Dec 16 19:50:18 GMT 2023`
Record UNII	VS3BZ5F9WP
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

Philanthotoxin-343

Common Name

English

(αS)-N-[3-[[4-[(3-Aminopropyl)amino]butyl]amino]propyl]-4-hydroxy-α-[(1-oxobutyl)amino]benzenepropanamide

Systematic Name

English

N-((2S)-1-(3-(4-(3-Azanylpropylamino)butylamino)propylamino)-3-(4-hydroxyphenyl)-1-(oxidanylidene-propan-2-yl)butanamide

Systematic Name

English

Benzenepropanamide, N-[3-[[4-[(3-aminopropyl)amino]butyl]amino]propyl]-4-hydroxy-α-[(1-oxobutyl)amino]-, (αS)-

Systematic Name

English

(S)-Philanthotoxin 343

Common Name

English

Code System Code Type Description

FDA UNII

VS3BZ5F9WP

Created by admin on Sat Dec 16 19:50:18 GMT 2023 , Edited by admin on Sat Dec 16 19:50:18 GMT 2023

PRIMARY

PUBCHEM

159548

Created by admin on Sat Dec 16 19:50:18 GMT 2023 , Edited by admin on Sat Dec 16 19:50:18 GMT 2023

PRIMARY

EPA CompTox

DTXSID20921884

Created by admin on Sat Dec 16 19:50:18 GMT 2023 , Edited by admin on Sat Dec 16 19:50:18 GMT 2023

PRIMARY

CAS

115976-93-7

Created by admin on Sat Dec 16 19:50:18 GMT 2023 , Edited by admin on Sat Dec 16 19:50:18 GMT 2023

PRIMARY