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Details

Stereochemistry ACHIRAL
Molecular Formula C18H18N2O3
Molecular Weight 310.3471
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-((3-HYDROXYPROPYL)AMINO)-4-(METHYLAMINO)ANTHRAQUINONE

SMILES

CNC1=CC=C(NCCCO)C2=C1C(=O)C3=CC=CC=C3C2=O

InChI

InChIKey=AWFZMEBVAIDNSS-UHFFFAOYSA-N
InChI=1S/C18H18N2O3/c1-19-13-7-8-14(20-9-4-10-21)16-15(13)17(22)11-5-2-3-6-12(11)18(16)23/h2-3,5-8,19-21H,4,9-10H2,1H3

HIDE SMILES / InChI

Molecular Formula C18H18N2O3
Molecular Weight 310.3471
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 13:09:28 GMT 2023
Edited
by admin
on Sat Dec 16 13:09:28 GMT 2023
Record UNII
CTA3PM3TF4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-((3-HYDROXYPROPYL)AMINO)-4-(METHYLAMINO)ANTHRAQUINONE
Systematic Name English
9,10-ANTHRACENEDIONE, 1-((3-HYDROXYPROPYL)AMINO)-4-(METHYLAMINO)-
Systematic Name English
1-((3-HYDROXYPROPYL)AMINO)-4-(METHYLAMINO)-9,10-ANTHRACENEDIONE
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
260-227-8
Created by admin on Sat Dec 16 13:09:28 GMT 2023 , Edited by admin on Sat Dec 16 13:09:28 GMT 2023
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CAS
56504-94-0
Created by admin on Sat Dec 16 13:09:28 GMT 2023 , Edited by admin on Sat Dec 16 13:09:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID1069112
Created by admin on Sat Dec 16 13:09:28 GMT 2023 , Edited by admin on Sat Dec 16 13:09:28 GMT 2023
PRIMARY
FDA UNII
CTA3PM3TF4
Created by admin on Sat Dec 16 13:09:28 GMT 2023 , Edited by admin on Sat Dec 16 13:09:28 GMT 2023
PRIMARY
PUBCHEM
91894
Created by admin on Sat Dec 16 13:09:28 GMT 2023 , Edited by admin on Sat Dec 16 13:09:28 GMT 2023
PRIMARY