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Substance Name: N,N-Pentamethylene-13-dihydroadriamycin hydrochloride
RN: 70844-21-2
InChIKey: VDSFIQDJZXVZTH-UHFFFAOYSA-N

Molecular Formula

  • C32-H39-N-O11

Molecular Weight

  • 613.656
 
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Names and Synonyms

Results Name

  • N,N-Pentamethylene-13-dihydroadriamycin hydrochloride

Synonyms

  • 8-(1,2-Dihydroxyethyl)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-10-((2,3,6-trideoxy-3-(1-piperidinyl)-alpha-L-lyxo-hexopyranosyl)oxy)-5,12-naphthacenedione (8S-cis)-
  • N,N-Pentamethylene-13-dihydroadriamycin hydrochloride

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 70844-21-2

System Generated Number

  • 0070844212

Structure Descriptors

InChI

1S/C32H39NO11/c1-15-27(36)18(33-9-4-3-5-10-33)11-22(43-15)44-20-13-32(41,21(35)14-34)12-17-24(20)31(40)26-25(29(17)38)28(37)16-7-6-8-19(42-2)23(16)30(26)39/h6-8,15,18,20-22,27,34-36,38,40-41H,3-5,9-14H2,1-2H3

InChIKey

VDSFIQDJZXVZTH-UHFFFAOYSA-N

Smiles

C1[C@@H](O[C@@H]2c3c(O)c4C(c5c(C(=O)c4c(O)c3C[C@@](C2)(O)[C@@H](O)CO)cccc5OC)=O)O[C@@H]([C@@H]([C@@H]1N1CCCCC1)O)C