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Details

Stereochemistry ACHIRAL
Molecular Formula C23H28N2O2
Molecular Weight 364.4806
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(Butylamino)-4-((3-methylbutyl)amino)anthraquinone

SMILES

CCCCNC1=C2C(=O)C3=C(C=CC=C3)C(=O)C2=C(NCCC(C)C)C=C1

InChI

InChIKey=UAWLYFQIAWYUDA-UHFFFAOYSA-N
InChI=1S/C23H28N2O2/c1-4-5-13-24-18-10-11-19(25-14-12-15(2)3)21-20(18)22(26)16-8-6-7-9-17(16)23(21)27/h6-11,15,24-25H,4-5,12-14H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C23H28N2O2
Molecular Weight 364.4806
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 Tue Apr 01 19:26:08 GMT 2025
Edited
by admin
on Tue Apr 01 19:26:08 GMT 2025
Record UNII
HJ4S3WPM9F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(Butylamino)-4-[(3-methylbutyl)amino]-9,10-anthracenedione
Preferred Name English
1-(Butylamino)-4-((3-methylbutyl)amino)anthraquinone
Systematic Name English
9,10-Anthracenedione, 1-(butylamino)-4-[(3-methylbutyl)amino]-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
287-127-7
Created by admin on Tue Apr 01 19:26:08 GMT 2025 , Edited by admin on Tue Apr 01 19:26:08 GMT 2025
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FDA UNII
HJ4S3WPM9F
Created by admin on Tue Apr 01 19:26:08 GMT 2025 , Edited by admin on Tue Apr 01 19:26:08 GMT 2025
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CAS
85409-57-0
Created by admin on Tue Apr 01 19:26:08 GMT 2025 , Edited by admin on Tue Apr 01 19:26:08 GMT 2025
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PUBCHEM
16205617
Created by admin on Tue Apr 01 19:26:08 GMT 2025 , Edited by admin on Tue Apr 01 19:26:08 GMT 2025
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EPA CompTox
DTXSID40234620
Created by admin on Tue Apr 01 19:26:08 GMT 2025 , Edited by admin on Tue Apr 01 19:26:08 GMT 2025
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