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Substance Name: 5-Imino-N-(1-carboethoxypropen-1-yl)daunorubicin
RN: 123618-02-0
InChIKey: QANWDFUNAMVWMA-XYMUIVMHSA-N

Molecular Formula

  • C33-H38-N2-O11

Molecular Weight

  • 638.6662
 
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Names and Synonyms

Results Name

  • 5-Imino-N-(1-carboethoxypropen-1-yl)daunorubicin

Name of Substance

  • 5-Imino-N-(1-carboethoxypropen-1-yl)daunorubicin

Synonyms

  • 5-Imino-N-(1-carboethoxypropen-1-yl)daunorubicin
  • DR-27

Systematic Name

  • 2-Butenoic acid, 2-((8-acetyl-10-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,9,10,12-tetrahydro-6,8,11-trihydroxy-1-methoxy-12-oxo-5(8H)-naphthacenylidene)amino)-, ethyl ester, (8S-cis)-

Registry Numbers

CAS Registry Number

  • 123618-02-0

System Generated Number

  • 0123618020

Structure Descriptors

InChI

1S/C33H38N2O11/c1-6-19(32(41)44-7-2)35-27-16-9-8-10-20(43-5)23(16)30(39)26-25(27)29(38)17-12-33(42,15(4)36)13-21(24(17)31(26)40)46-22-11-18(34)28(37)14(3)45-22/h6,8-10,14,18,21-22,28,37-38,40,42H,7,11-13,34H2,1-5H3/b19-6+,35-27+

InChIKey

QANWDFUNAMVWMA-XYMUIVMHSA-N

Smiles

CCOC(=O)/C(=C\C)/N=C/1\c2cccc(c2C(=O)c3c1c(c4c(c3O)C(CC(C4)(C(=O)C)O)OC5CC(C(C(O5)C)O)N)O)OC