AMINOMETHYLTRIOXSALEN

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H15NO3
Molecular Weight	257.2845
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=C(CN)C2=CC3=C(OC(=O)C=C3C)C(C)=C2O1

InChI

InChIKey=WBIICVGYYRRURR-UHFFFAOYSA-N

InChI=1S/C15H15NO3/c1-7-4-13(17)19-14-8(2)15-11(5-10(7)14)12(6-16)9(3)18-15/h4-5H,6,16H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C15H15NO3
Molecular Weight	257.2845
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
DNA 278 Target ID: CHEMBL2311221 Sources: https://www.ncbi.nlm.nih.gov/pubmed/7370270 \| https://www.ncbi.nlm.nih.gov/pubmed/8619806	Crosslinking Agent 81
RNA 19 Target ID: CHEMBL2311222 Sources: https://www.ncbi.nlm.nih.gov/pubmed/116192 \| https://www.ncbi.nlm.nih.gov/pubmed/284397	Crosslinking Agent 81

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:17:33 GMT 2023` Edited by `admin` on `Fri Dec 15 18:17:33 GMT 2023`
Record UNII	9RZS3WBN9X
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

AMINOMETHYLTRIOXSALEN

Common Name

English

3-(AMINOMETHYL)-2,5,9-TRIMETHYL-7H-FURO(3,2-G)(1)BENZOPYRAN-7-ONE

Systematic Name

English

TRIOXSALEN AMINE

Common Name

English

4'-AMINOMETHYL-4,5',8-TRIMETHYLPSORALEN

Systematic Name

English

4'-AMINOMETHYLTRIOXSALEN

Systematic Name

English

7H-FURO(3,2-G)(1)BENZOPYRAN-7-ONE, 3-(AMINOMETHYL)-2,5,9-TRIMETHYL-

Systematic Name

English

Code System Code Type Description

PUBCHEM

107680

Created by admin on Fri Dec 15 18:17:33 GMT 2023 , Edited by admin on Fri Dec 15 18:17:33 GMT 2023

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FDA UNII

9RZS3WBN9X

Created by admin on Fri Dec 15 18:17:33 GMT 2023 , Edited by admin on Fri Dec 15 18:17:33 GMT 2023

PRIMARY

EPA CompTox

DTXSID70982900

Created by admin on Fri Dec 15 18:17:33 GMT 2023 , Edited by admin on Fri Dec 15 18:17:33 GMT 2023

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CAS

64358-50-5

Created by admin on Fri Dec 15 18:17:33 GMT 2023 , Edited by admin on Fri Dec 15 18:17:33 GMT 2023

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