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Substance Name: 13,13-Dihydro-3'-(1-piperidinyl)-3'-deaminodaunorubicin hydrochloride
RN: 74985-08-3
InChIKey: UHGSEWHDUWVGGF-UHFFFAOYSA-N

Molecular Formula

  • C32-H39-N-O10.Cl-H

Molecular Weight

  • 634.118
 
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Names and Synonyms

Results Name

  • 13,13-Dihydro-3'-(1-piperidinyl)-3'-deaminodaunorubicin hydrochloride

Synonym

  • 7,8,9,10-Tetrahydro-6,8,11-trihydroxy-8-(1-hydroxyethyl)-1-methoxy-10-((2,3,6-trideoxy-3-(1-piperidinyl)-alpha-L-lyxo-hexopyranosyl)oxy)-5,12-naphthacenedione hydrochloride, (8S-cis)-

Systematic Name

  • 5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(1-hydroxyethyl)-1-methoxy-10-((2,3,6-trideoxy-3-(1-piperidinyl)-alpha-L-lyxo-hexopyranosyl)oxy)-, hydrochloride, (8S-cis)-

Registry Numbers

CAS Registry Number

  • 74985-08-3

System Generated Number

  • 0074985083

Molecular Formulas

Molecular Formula

  • C32-H39-N-O10.Cl-H

Molecular Formula Fragments

  • C32-H39-N-O10
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C32H39NO10.ClH/c1-15-27(35)19(33-10-5-4-6-11-33)12-22(42-15)43-21-14-32(40,16(2)34)13-18-24(21)31(39)26-25(29(18)37)28(36)17-8-7-9-20(41-3)23(17)30(26)38;/h7-9,15-16,19,21-22,27,34-35,37,39-40H,4-6,10-14H2,1-3H3;1H

InChIKey

UHGSEWHDUWVGGF-UHFFFAOYSA-N

Smiles

N1(CCCCC1)[C@@H]1C[C@@H](O[C@@H]2C[C@@]([C@@H](C)O)(Cc3c(O)c4C(=O)c5cccc(OC)c5C(=O)c4c(O)c23)O)O[C@@H]([C@@H]1O)C.Cl