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Substance Name: Adriamycin-14-glycolate
RN: 63909-08-0
InChIKey: GPQHXDURKCDULM-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C29-H31-N-O13.Cl-H

Molecular Weight

  • 638.0188
 
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Names and Synonyms

Results Name

  • Adriamycin-14-glycolate

Synonym

  • Adriamycin-14-glycolate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 63909-08-0

System Generated Number

  • 0063909080

Molecular Formulas

Molecular Formula

  • C29-H31-N-O13.Cl-H

Molecular Formula Fragments

  • C29-H31-N-O13
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C29H31NO13.ClH/c1-11-24(34)14(30)6-19(42-11)43-16-8-29(39,17(32)10-41-18(33)9-31)7-13-21(16)28(38)23-22(26(13)36)25(35)12-4-3-5-15(40-2)20(12)27(23)37;/h3-5,11,14,16,19,24,31,34,36,38-39H,6-10,30H2,1-2H3;1H

InChIKey

GPQHXDURKCDULM-UHFFFAOYSA-N

Smiles

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