Chemical Compound

1-(ACETYLOXY)-5-{[(2S,3S,4S,6R)-3-HYDROXY-2-METHYL-6-{[(1S,3S)-3,5,12-TRIHYDROXY-3-(2-HYDROXYACETYL)-10-METHOXY-6,11-DIOXO-1,2,3,4,6,11-HEXAHYDROTETRACEN-1-YL]OXY}OXAN-4-YL]AMINO}PENTYL ACETATE

CAS Registry Number 138967-27-8
1-(ACETYLOXY)-5-{[(2S,3S,4S,6R)-3-HYDROXY-2-METHYL-6-{[(1S,3S)-3,5,12-TRIHYDROXY-3-(2-HYDROXYACETYL)-10-METHOXY-6,11-DIOXO-1,2,3,4,6,11-HEXAHYDROTETRACEN-1-YL]OXY}OXAN-4-YL]AMINO}PENTYL ACETATE 结构式
Primary record

1-(ACETYLOXY)-5-{[(2S,3S,4S,6R)-3-HYDROXY-2-METHYL-6-{[(1S,3S)-3,5,12-TRIHYDROXY-3-(2-HYDROXYACETYL)-10-METHOXY-6,11-DIOXO-1,2,3,4,6,11-HEXAHYDROTETRACEN-1-YL]OXY}OXAN-4-YL]AMINO}PENTYL ACETATE

库存
9,187 克
纯度
99.6 %
CAS
138967-27-8

化合物标识与属性

CAS
138967-27-8
PubChem CID
164413
SMILES
C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)NCCCCC(OC(=O)C)OC(=O)C)O
Canonical SMILES
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H](NCCCCC(OC(C)=O)OC(C)=O)[C@H](O)[C@H](C)O1

名称与同义词

  • Dapdox
  • N-(5,5-Dap)dox
  • AC1L4UQP
  • AC1Q5YDG
  • RefChem:162214
  • N-(5,5-Diacetoxypentyl)doxorubicin
  • SCHEMBL29398144
  • DTXSID70930264
  • C36H43NO15
  • AR-1G5779
  • CID164413
  • C36-H43-N-O15
  • J462.716D
  • 138967-27-8
  • [1-acetyloxy-5-[[(2S,3S,4S,6R)-3-hydroxy-2-methyl-6-[[(1S,3S)-3,5,12-trihydroxy-3-(2-hydroxyacetyl)-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]oxan-4-yl]amino]pentyl] acetate
  • 5,12-naphthacenedione, 10-((3-((5,5-bis(acetoxy)pentyl)amino)-2,3,6-trideoxy-|A-l-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-,(8s-cis)-
  • (1S,3S)-3,5,12-trihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-{[5,5-bis(acetyloxy)pentyl]amino}-2,3,6-trideoxy-alpha-L-lyxo-hexopyranoside
  • (8S)-1-Methoxy-6,8alpha,11-trihydroxy-8-(hydroxyacetyl)-10alpha-[3-(5,5-diacetoxypentylamino)-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyloxy]-7,8,9,10-tetrahydronaphthacene-5,12-dione
  • (8S)-10alpha-[[3-[(5,5-Diacetoxypentyl)amino]-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl]oxy]-7,8,9,10-tetrahydro-6,8alpha,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-5,12-naphthacenedione
  • 1-(ACETYLOXY)-5-{[(2S,3S,4S,6R)-3-HYDROXY-2-METHYL-6-{[(1S,3S)-3,5,12-TRIHYDROXY-3-(2-HYDROXYACETYL)-10-METHOXY-6,11-DIOXO-1,2,3,4,6,11-HEXAHYDROTETRACEN-1-YL]OXY}OXAN-4-YL]AMINO}PENTYL ACETATE
  • 16143-80-9
  • 3,5,12-Trihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-{[5,5-bis(acetyloxy)pentyl]amino}-2,3,6-trideoxyhexopyranoside
  • 5,12-Naphthacenedione, 10-((3-((5,5-bis(acetoxy)pentyl)amino)-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-, (8S-cis)-