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Substance Name: 9-Hydroxymethyl-9-deacetyldaunorubicin hydrochloride
RN: 73068-98-1
InChIKey: LQLMJJJLWJUAMM-UHFFFAOYSA-N

Molecular Formula

  • C26-H29-N-O10.Cl-H

Molecular Weight

  • 565.9998
 
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Names and Synonyms

Results Name

  • 9-Hydroxymethyl-9-deacetyldaunorubicin hydrochloride

Synonyms

  • 9-Hydroxymethyl-9-deacetyldaunorubicin hydrochloride
  • NSC 272681

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 73068-98-1

System Generated Number

  • 0073068981

Molecular Formulas

Molecular Formula

  • C26-H29-N-O10.Cl-H

Molecular Formula Fragments

  • C26-H29-N-O10
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C27H31NO10.ClH/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;/h4-6,10-11,14,16-17,22,29-30,32,34-35H,7-9,28H2,1-3H3;1H

InChIKey

LQLMJJJLWJUAMM-UHFFFAOYSA-N

Smiles

CC1C(C(CC(O1)OC2CC(Cc3c2c(c4c(c3O)C(=O)c5cccc(c5C4=O)OC)O)(C(C)O)O)N)O.Cl