773U82 HYDROCHLORIDE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H21NO2.ClH
Molecular Weight	355.858
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 773U82 HYDROCHLORIDE

Structure Search

SMILES

Cl.CC(CO)(CO)NCC1=C2C=CC=C3C4=CC=CC=C4C(C=C1)=C23

InChI

InChIKey=XPSPHVAGYMFPFA-UHFFFAOYSA-N

InChI=1S/C21H21NO2.ClH/c1-21(12-23,13-24)22-11-14-9-10-19-17-6-3-2-5-16(17)18-8-4-7-15(14)20(18)19;/h2-10,22-24H,11-13H2,1H3;1H

HIDE SMILES / InChI

Molecular Formula	C21H21NO2
Molecular Weight	319.3969
Charge	0
Count

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

Molecular Formula	ClH
Molecular Weight	36.461
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 `Mon Mar 31 18:00:45 GMT 2025` Edited by `admin` on `Mon Mar 31 18:00:45 GMT 2025`
Record UNII	PO86XD1U2Y
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BW-A-773U

Preferred Name

English

773U82 HYDROCHLORIDE

Code

English

1,3-PROPANEDIOL, 2-((3-FLUORANTHENYLMETHYL)AMINO)-2-METHYL-, HYDROCHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

CAS

96404-51-2

Created by admin on Mon Mar 31 18:00:45 GMT 2025 , Edited by admin on Mon Mar 31 18:00:45 GMT 2025

PRIMARY

FDA UNII

PO86XD1U2Y

Created by admin on Mon Mar 31 18:00:45 GMT 2025 , Edited by admin on Mon Mar 31 18:00:45 GMT 2025

PRIMARY

PUBCHEM

3024572

Created by admin on Mon Mar 31 18:00:45 GMT 2025 , Edited by admin on Mon Mar 31 18:00:45 GMT 2025

PRIMARY

EPA CompTox

DTXSID30242239

Created by admin on Mon Mar 31 18:00:45 GMT 2025 , Edited by admin on Mon Mar 31 18:00:45 GMT 2025

PRIMARY

NCI_THESAURUS

C1339

Created by admin on Mon Mar 31 18:00:45 GMT 2025 , Edited by admin on Mon Mar 31 18:00:45 GMT 2025

PRIMARY

Related Record Type Details


					CR91BPI5TT

773U82

PARENT -> SALT/SOLVATE