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Details

Stereochemistry EPIMERIC
Molecular Formula C21H20O8
Molecular Weight 400.3787
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 13-DIHYDRODAUNORUBICINONE

SMILES

COC1=C2C(=O)C3=C(C(=O)C2=CC=C1)C(O)=C4C[C@](O)(C[C@H](O)C4=C3O)C(C)O

InChI

InChIKey=OWCHPBVMSHIYCQ-VNMREYGJSA-N
InChI=1S/C21H20O8/c1-8(22)21(28)6-10-13(11(23)7-21)19(26)16-15(18(10)25)17(24)9-4-3-5-12(29-2)14(9)20(16)27/h3-5,8,11,22-23,25-26,28H,6-7H2,1-2H3/t8?,11-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H20O8
Molecular Weight 400.3787
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:06:06 UTC 2023
Edited
by admin
on Sat Dec 16 11:06:06 UTC 2023
Record UNII
228PJ9T8WQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
13-DIHYDRODAUNORUBICINONE
Common Name English
(8S,10S)-6,8,10,11-TETRAHYDROXY-8-((1RS)-1-HYDROXYETHYL)-1-METHOXY-7,8,9,10-TETRAHYDROTETRACENE-5,12-DIONE
Systematic Name English
DAUNORUBICIN HYDROCHLORIDE IMPURITY E [EP IMPURITY]
Common Name English
Code System Code Type Description
FDA UNII
228PJ9T8WQ
Created by admin on Sat Dec 16 11:06:06 UTC 2023 , Edited by admin on Sat Dec 16 11:06:06 UTC 2023
PRIMARY
PUBCHEM
147191
Created by admin on Sat Dec 16 11:06:06 UTC 2023 , Edited by admin on Sat Dec 16 11:06:06 UTC 2023
PRIMARY
Related Record Type Details
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EP