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Substance Name: Iododoxorubicin hydrochloride
RN: 83943-83-3
UNII: 31I1O326SE
InChIKey: RIXHOXYAFWQBGU-RUELKSSGSA-N

Molecular Formula

  • C27-H28-I-N-O10.Cl-H

Molecular Weight

  • 689.8761
 
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Names and Synonyms

Name of Substance

  • Iododoxorubicin hydrochloride

Synonyms

  • 4'-Iodo-4'-deoxydoxorubicin hydrochloride
  • 5,12-Naphthacenedione, 10-(((2R,4S,5S,6S)-4-aminotetrahydro-5-iodo-6-methyl-2H-pyran-2-yl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-, hydrochloride, (8S,10S)-
  • Iododoxorubicin HCl
  • Iododoxorubicin hydrochloride
  • UNII-31I1O326SE

Registry Numbers

CAS Registry Number

  • 83943-83-3

FDA UNII

  • 31I1O326SE

System Generated Number

  • 0083943833

Structure Descriptors

InChI

1S/C27H28INO10.ClH/c1-10-22(28)13(29)6-17(38-10)39-15-8-27(36,16(31)9-30)7-12-19(15)26(35)21-20(24(12)33)23(32)11-4-3-5-14(37-2)18(11)25(21)34;/h3-5,10,13,15,17,22,30,33,35-36H,6-9,29H2,1-2H3;1H/t10-,13-,15-,17-,22+,27-;/m0./s1

InChIKey

RIXHOXYAFWQBGU-RUELKSSGSA-N

Smiles

C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](Cc3c2c(c4c(c3O)C(=O)c5cccc(c5C4=O)OC)O)(C(=O)CO)O)N)I.Cl