Chemical Compound

(8S,10S)-10-{[(2R,4S,5S,6S)-4-({3-[(1S,3aS,3bR,9bS,11aS)-1,7-dihydroxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]prop-2-yn-1-yl}amino)-5-hydroxy-6-methyloxan-2-yl]oxy}-8-acetyl-6,8,11-trihydroxy-1-methoxy-5,7,8,9,10,12-hexahydrotetracene-5,12-dione

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(8S,10S)-10-{[(2R,4S,5S,6S)-4-({3-[(1S,3aS,3bR,9bS,11aS)-1,7-dihydroxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]prop-2-yn-1-yl}amino)-5-hydroxy-6-methyloxan-2-yl]oxy}-8-acetyl-6,8,11-trihydroxy-1-methoxy-5,7,8,9,10,12-hexahydrotetracene-5,12-dione 结构式
Primary record

(8S,10S)-10-{[(2R,4S,5S,6S)-4-({3-[(1S,3aS,3bR,9bS,11aS)-1,7-dihydroxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]prop-2-yn-1-yl}amino)-5-hydroxy-6-methyloxan-2-yl]oxy}-8-acetyl-6,8,11-trihydroxy-1-methoxy-5,7,8,9,10,12-hexahydrotetracene-5,12-dione

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
10930875
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)C)O)NCC#C[C@@]6(CC[C@@H]7[C@@]6(CC[C@H]8[C@H]7CCC9=C8C=CC(=C9)O)C)O)O
Canonical SMILES
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1C[C@H](NCC#C[C@]2(O)CC[C@H]3[C@@H]4CCc5cc(O)ccc5[C@H]4CC[C@@]32C)[C@H](O)[C@H](C)O1

名称与同义词

  • CID10930875
  • CID 10079210
  • J1.569.027E
  • Daunorubicin-3 -NH-17alpha-(propargyl)-3,17beta-estradiol
  • (8S)-1-Methoxy-6,8,11-trihydroxy-8beta-acetyl-10alpha-[3-[[(17S)-3,17-dihydroxy-19-norpregna-1,3,5(10)-triene-20-yne-21-yl]methylamino]-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyloxy]-5,7,8,9,10,12-hexahydronaphthacene-5,12-dione
  • (8S,10S)-10-{[(2R,4S,5S,6S)-4-({3-[(1S,3aS,3bR,9bS,11aS)-1,7-dihydroxy-11a-methyl-1H,2H,3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]prop-2-yn-1-yl}amino)-5-hydroxy-6-methyloxan-2-yl]oxy}-8-acetyl-6,8,11-trihydroxy-1-methoxy-5,7,8,9,10,12-hexahydrotetracene-5,12-dione