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Substance Name: 4'-O-Demethyl-4-((4''-(1''-benzylpiperidinyl))amino)-4-desoxypodophyllotoxin
RN: 152833-13-1
InChIKey: GQMFUALQPLOONU-QIXIFPRPSA-N

Note

  • A 4beta-amino derivative of etoposide.

Molecular Formula

  • C33-H36-N2-O7

Molecular Weight

  • 572.6544
 
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Names and Synonyms

Name of Substance

  • 4'-O-Demethyl-4-((4''-(1''-benzylpiperidinyl))amino)-4-desoxypodophyllotoxin

Synonyms

  • 5,8,8a,9-Tetrahydro-5-(4-hydroxy-3,5-dimethoxyphenyl)-9-((1-(phenylmethyl)-4-piperidinyl)amino)furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5aH)-one (5R-(5alpha,5abeta,8aalpha,9beta))-
  • Dbadptx

Systematic Name

  • Furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5aH)-one, 5,8,8a,9-tetrahydro-5-(4-hydroxy-3,5-dimethoxyphenyl)-9-((1-(phenylmethyl)-4-piperidinyl)amino)-, (5R-(5alpha,5abeta,8aalpha,9beta))-

Registry Numbers

CAS Registry Number

  • 152833-13-1

System Generated Number

  • 0152833131

Structure Descriptors

InChI

1S/C33H36N2O7/c1-38-27-12-20(13-28(39-2)32(27)36)29-22-14-25-26(42-18-41-25)15-23(22)31(24-17-40-33(37)30(24)29)34-21-8-10-35(11-9-21)16-19-6-4-3-5-7-19/h3-7,12-15,21,24,29-31,34,36H,8-11,16-18H2,1-2H3/t24-,29+,30-,31+/m0/s1

InChIKey

GQMFUALQPLOONU-QIXIFPRPSA-N

Smiles

COc1cc(cc(c1O)OC)[C@@H]2c3cc4c(cc3[C@H]([C@@H]5[C@@H]2C(=O)OC5)NC6CCN(CC6)Cc7ccccc7)OCO4