U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C22H27N5O4.2ClH
Molecular Weight 498.403
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LOSOXANTRONE HYDROCHLORIDE ANHYDROUS

SMILES

Cl.Cl.OCCNCCNC1=CC=C2N(CCNCCO)N=C3C2=C1C(=O)C4=C3C=CC=C4O

InChI

InChIKey=XDMHALQMTPSGEA-UHFFFAOYSA-N
InChI=1S/C22H27N5O4.2ClH/c28-12-9-23-6-7-25-15-4-5-16-20-19(15)22(31)18-14(2-1-3-17(18)30)21(20)26-27(16)11-8-24-10-13-29;;/h1-5,23-25,28-30H,6-13H2;2*1H

HIDE SMILES / InChI

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

Molecular Formula C22H27N5O4
Molecular Weight 425.4809
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 07:01:49 UTC 2023
Edited
by admin
on Sat Dec 16 07:01:49 UTC 2023
Record UNII
JWB98HG9FS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LOSOXANTRONE HYDROCHLORIDE ANHYDROUS
Common Name English
Losoxantrone hydrochloride [WHO-DD]
Common Name English
7-HYDROXY-2-(2-((2-HYDROXYETHYL)AMINO)ETHYL)-5-((2-((2-HYDROXYETHYL)AMINO)ETHYL)AMINO)ANTHRA(1,9-CD)PYRAZOL-6(2H)-ONE, DIHYDROCHLORIDE
Common Name English
DIBENZ(CD,G)INDAZOL-6(2H)-ONE, 7-HYDROXY-2-(2-((2-HYDROXYETHYL)AMINO)ETHYL)-5-((2-((2-HYDROXYETHYL)AMINO)ETHYL)AMINO)-, HYDROCHLORIDE (1:2)
Systematic Name English
Code System Code Type Description
CAS
88303-61-1
Created by admin on Sat Dec 16 07:01:49 UTC 2023 , Edited by admin on Sat Dec 16 07:01:49 UTC 2023
PRIMARY
PUBCHEM
73349
Created by admin on Sat Dec 16 07:01:49 UTC 2023 , Edited by admin on Sat Dec 16 07:01:49 UTC 2023
PRIMARY
EPA CompTox
DTXSID70236950
Created by admin on Sat Dec 16 07:01:49 UTC 2023 , Edited by admin on Sat Dec 16 07:01:49 UTC 2023
PRIMARY
FDA UNII
JWB98HG9FS
Created by admin on Sat Dec 16 07:01:49 UTC 2023 , Edited by admin on Sat Dec 16 07:01:49 UTC 2023
PRIMARY
Related Record Type Details
SOLVATE->ANHYDROUS
Related Record Type Details
ACTIVE MOIETY