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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H29NO10.C6H8O7
Molecular Weight 719.6434
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DAUNORUBICIN CITRATE

SMILES

OC(=O)CC(O)(CC(O)=O)C(O)=O.[H][C@@]1(C[C@@](O)(CC2=C(O)C3=C(C(=O)C4=C(C=CC=C4OC)C3=O)C(O)=C12)C(C)=O)O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5

InChI

InChIKey=VNTHYLVDGVBPOU-QQYBVWGSSA-N
InChI=1S/C27H29NO10.C6H8O7/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t10-,14-,16-,17-,22+,27-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C6H8O7
Molecular Weight 192.1235
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C27H29NO10
Molecular Weight 527.5199
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:56:03 UTC 2023
Edited
by admin
on Fri Dec 15 15:56:03 UTC 2023
Record UNII
5L84T2Z6NP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DAUNORUBICIN CITRATE
MART.   ORANGE BOOK   WHO-DD  
Common Name English
Daunorubicin Citrate [WHO-DD]
Common Name English
DAUNORUBICIN LIPOSOMAL
Brand Name English
5,12-NAPHTHACENEDIONE, 8-ACETYL-10-((3-AMINO-2,3,6-TRIDEOXY-.ALPHA.-L-LYXO-HEXOPYRANOSYL)OXY)-7,8,9,10-TETRAHYDRO-6,8,11-TRIHYDROXY-1-METHOXY-, (8S,10S)-, 2-HYDROXY-1,2,3-PROPANETRICARBOXYLATE (1:1)
Common Name English
DAUNORUBICIN CITRATE [ORANGE BOOK]
Common Name English
5,12-NAPHTHACENEDIONE, 8-ACETYL-10-((3-AMINO-2,3,6-TRIDEOXY-.ALPHA.-L-LYXO-HEXOPYRANOSYL)OXY)-7,8,9,10-TETRAHYDRO-6,8,11-TRIHYDROXY-1-METHOXY-, (8S,10S)-, 2-HYDROXY-1,2,3-PROPANETRICARBOXYLATE (1:1) (SALT)
Common Name English
DAUNOXOME
Brand Name English
DAUNORUBICIN CITRATE LIPOSOME
VANDF  
Common Name English
DAUNORUBICIN CITRATE LIPOSOME [VANDF]
Common Name English
DAUNORUBICIN CITRATE [MART.]
Common Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 73693
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
FDA ORPHAN DRUG 266508
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
FDA ORPHAN DRUG 393413
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
NCI_THESAURUS C1594
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
EU-Orphan Drug EU/3/08/585
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
Code System Code Type Description
EPA CompTox
DTXSID20190659
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
PRIMARY
RXCUI
221087
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
PRIMARY
CAS
371770-68-2
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
PRIMARY
DRUG BANK
DBSALT001476
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
PRIMARY
ChEMBL
CHEMBL178
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
PRIMARY
NCI_THESAURUS
C47471
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
PRIMARY
SMS_ID
100000086576
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
PRIMARY
PUBCHEM
9961878
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
PRIMARY
FDA UNII
5L84T2Z6NP
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
PRIMARY
RXCUI
1364321
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
ALTERNATIVE
RXCUI
214468
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
ALTERNATIVE
EVMPD
SUB22734
Created by admin on Fri Dec 15 15:56:03 UTC 2023 , Edited by admin on Fri Dec 15 15:56:03 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
Biological Half-life PHARMACOKINETIC
Volume of Distribution PHARMACOKINETIC