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Details

Stereochemistry ACHIRAL
Molecular Formula C19H12O6
Molecular Weight 336.295
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6,8,11-Trihydroxy-1-methoxy-5,12-naphthacenedione

SMILES

COC1=C2C(=O)C3=C(O)C4=CC=C(O)C=C4C(O)=C3C(=O)C2=CC=C1

InChI

InChIKey=HVWINTHXQUZYHP-UHFFFAOYSA-N
InChI=1S/C19H12O6/c1-25-12-4-2-3-10-13(12)19(24)15-14(17(10)22)18(23)11-7-8(20)5-6-9(11)16(15)21/h2-7,20-21,23H,1H3

HIDE SMILES / InChI

Molecular Formula C19H12O6
Molecular Weight 336.295
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 19:54:02 GMT 2023
Edited
by admin
on Sat Dec 16 19:54:02 GMT 2023
Record UNII
A9HWV9M6ZR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6,8,11-Trihydroxy-1-methoxy-5,12-naphthacenedione
Systematic Name English
Doxorubicin Impurity 2
Common Name English
5,12-Naphthacenedione, 6,8,11-trihydroxy-1-methoxy-
Systematic Name English
7,8-Dehydro-9,10-desacetyldoxorubicinone
Systematic Name English
Code System Code Type Description
CAS
64845-67-6
Created by admin on Sat Dec 16 19:54:02 GMT 2023 , Edited by admin on Sat Dec 16 19:54:02 GMT 2023
PRIMARY
FDA UNII
A9HWV9M6ZR
Created by admin on Sat Dec 16 19:54:02 GMT 2023 , Edited by admin on Sat Dec 16 19:54:02 GMT 2023
PRIMARY
PUBCHEM
125152
Created by admin on Sat Dec 16 19:54:02 GMT 2023 , Edited by admin on Sat Dec 16 19:54:02 GMT 2023
PRIMARY