Chemical Compound

(2R,3R,4S,6S)-6-(((2R,3R,4S,6S)-4-(formyloxy)-6-(((2R,3R,4S,6R)-4-(formyloxy)-6-(((3S,5R,8R,9S,10S,13R,14S,16S,17R)-16-(formyloxy)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2,5-dihydrofuran-3-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-2-methyltetrahydro-2H-pyran-3-yl)oxy)-2-methyltetrahydro-2H-pyran-3-yl)oxy)-2-methyltetrahydro-2H-pyran-3,4-diyl diformate

CAS Registry Number 10176-39-3
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(2R,3R,4S,6S)-6-(((2R,3R,4S,6S)-4-(formyloxy)-6-(((2R,3R,4S,6R)-4-(formyloxy)-6-(((3S,5R,8R,9S,10S,13R,14S,16S,17R)-16-(formyloxy)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2,5-dihydrofuran-3-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-2-methyltetrahydro-2H-pyran-3-yl)oxy)-2-methyltetrahydro-2H-pyran-3-yl)oxy)-2-methyltetrahydro-2H-pyran-3,4-diyl diformate 结构式
Primary record

(2R,3R,4S,6S)-6-(((2R,3R,4S,6S)-4-(formyloxy)-6-(((2R,3R,4S,6R)-4-(formyloxy)-6-(((3S,5R,8R,9S,10S,13R,14S,16S,17R)-16-(formyloxy)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2,5-dihydrofuran-3-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-2-methyltetrahydro-2H-pyran-3-yl)oxy)-2-methyltetrahydro-2H-pyran-3-yl)oxy)-2-methyltetrahydro-2H-pyran-3,4-diyl diformate

库存
9,953 克
纯度
99.7 %
CAS
10176-39-3

化合物标识与属性

CAS
10176-39-3
PubChem CID
20055283
SMILES
C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@@H]2[C@H](O[C@H](C[C@@H]2OC=O)O[C@@H]3[C@H](O[C@H](C[C@@H]3OC=O)O[C@H]4CC[C@]5([C@@H](C4)CC[C@@H]6[C@@H]5CC[C@]7([C@@]6(C[C@@H]([C@@H]7C8=CC(=O)OC8)OC=O)O)C)C)C)C)OC=O)OC=O
Canonical SMILES
C[C@H]1O[C@@H](O[C@H]2[C@@H](OC=O)C[C@H](O[C@H]3[C@@H](OC=O)C[C@H](O[C@H]4CC[C@@]5(C)[C@H](CC[C@@H]6[C@@H]5CC[C@]5(C)[C@@H](C7=CC(=O)OC7)[C@@H](OC=O)C[C@]65O)C4)O[C@@H]3C)O[C@@H]2C)C[C@H](OC=O)[C@@H]1OC=O

名称与同义词

  • Gitoformate
  • Formiloxine
  • Formiloxin
  • Pentaformylgitoxin
  • Gitoformato
  • Gitoformatum
  • Gitoxin, pentaformate
  • Gitoformat
  • Gitoformate [INN]
  • gitoxin pentaformate
  • Gitoformato [Spanish]
  • Gitoformatum [INN-Latin]
  • Gitoformato [INN-Spanish]
  • RefChem:143251
  • AC 2770
  • UNII-B69U29O7J9
  • B69U29O7J9
  • GITOFORMATE [MART.]
  • GITOFORMATE [WHO-DD]
  • SCHEMBL525949
  • AC-2770
  • CHEMBL2103959
  • DTXCID0066664
  • EINECS 233-450-3
  • C01AA09
  • DTXSID80144173
  • DOMHWKQEPDYUQX-LJAQBGIBSA-N
  • 10176-39-3
  • AC 2770; Formiloxin; Formiloxine
  • C46H64O19
  • DB13537
  • J8.961C
  • C46-H64-O19
  • HY-106530
  • CS-0025997
  • Gitoxin 3',3'',3''',4''',16-pentaformate
  • Gitoxin 3',3',3''',4''',16-pentaformate
  • [(2R,3R,4S,6R)-3-[(2S,4S,5R,6R)-5-[(2S,4S,5R,6R)-4,5-diformyloxy-6-methyloxan-2-yl]oxy-4-formyloxy-6-methyloxan-2-yl]oxy-6-[[(3S,5R,8R,9S,10S,13R,14S,16S,17R)-16-formyloxy-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-methyloxan-4-yl] formate
  • (2R,3R,4S,6S)-6-(((2R,3R,4S,6S)-4-(formyloxy)-6-(((2R,3R,4S,6R)-4-(formyloxy)-6-(((3S,5R,8R,9S,10S,13R,14S,16S,17R)-16-(formyloxy)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2,5-dihydrofuran-3-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-2-methyltetrahydro-2H-pyran-3-yl)oxy)-2-methyltetrahydro-2H-pyran-3-yl)oxy)-2-methyltetrahydro-2H-pyran-3,4-diyl diformate
  • Gitoxin 3 ,3 ,3 ,4 ,16-pentaformate
  • ((2R,3R,4S,6R)-3-((2S,4S,5R,6R)-5-((2S,4S,5R,6R)-4,5-diformyloxy-6-methyloxan-2-yl)oxy-4-formyloxy-6-methyloxan-2-yl)oxy-6-(((3S,5R,8R,9S,10S,13R,14S,16S,17R)-16-formyloxy-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta(a)phenanthren-3-yl)oxy)-2-methyloxan-4-yl) formate
  • (1R,2S,3aS,3bR,5aR,7S,9aS,9bS,11aR)-7-{[(2R,4S,5R,6R)-5-{[(2S,4S,5R,6R)-5-{[(2S,4S,5R,6R)-4,5-bis(formyloxy)-6-methyloxan-2-yl]oxy}-4-(formyloxy)-6-methyloxan-2-yl]oxy}-4-(formyloxy)-6-methyloxan-2-yl]oxy}-3a-hydroxy-9a,11a-dimethyl-1-(5-oxo-2,5-dihydrofuran-3-yl)-hexadecahydro-1H-cyclopenta[a]phenanthren-2-yl formate
  • (3 beta,5 beta,16 beta)-3-((O-2,6-dideoxy-3,4-di-O-formyl-beta-D-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-3-O-formyl-beta-D-ribo-hexanopyranosyl-(1-4)-2,6-dide oxy-3-O-formyl-beta-D-ribo-hexanopyranosyl)oxy)-16-(formyloxy)-14-hydroxycard-20(22)-enolide
  • (3beta,5beta,16beta)-3-((O-2,6-Dideoxy-3,4-di-O-formyl-beta-D-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-3-O-formyl-beta-D-ribo-hexanopyranosyl-(1-4)-2,6-dide oxy-3-O-formyl-beta-D-ribo-hexanopyranosyl)oxy)-16-(formyloxy)-14-hydroxycard-20(22)-enolide
  • 233-450-3
  • 3 beta,14 beta- dihydroxy-16 beta-formyloxy-5 beta-card-20(22)- enolide 3-tetraformyltridigitoxoside
  • 3 beta,14 beta-dihydroxy-16 beta-formyloxy-5 beta-card-20(22)-enolide 3-tetraformyltridigitoxoside
  • 3beta-[[4-O-[4-O-(2,6-Dideoxy-3-O,4-O-diformyl-beta-D-ribo-hexopyranosyl)-2,6-dideoxy-3-O-formyl-beta-D-ribo-hexopyranosyl]-2,6-dideoxy-3-O-formyl-beta-D-ribo-hexopyranosyl]oxy]-16beta-formyloxy-14-hydroxy-5beta,14beta-card-20(22)-enolide
  • 3beta-[[4-O-[4-O-(3-O,4-O-Diformyl-2,6-dideoxy-beta-D-ribo-hexopyranosyl)-3-O-formyl-2,6-dideoxy-beta-D-ribo-hexopyranosyl]-3-O-formyl-2,6-dideoxy-beta-D-ribo-hexopyranosyl]oxy]-16beta-formyloxy-14-hydroxy-5beta-card-20(22)-enolide
  • Card-20(22)-enolide, 3-((O-2,6-dideoxy-3,4-di-O-formyl-beta-D-ribo-hexopyranosyl-(1-4)-O-2,6-dideoxy-3-O-formyl-beta-D-ribo-hexopyranosyl-(1-4)-2,6-dideoxy-3-O-formyl-beta-D-ribo-hexopyranosyl)oxy)-16-(formyloxy)-14-hydroxy-, (3-beta,5-beta,16-beta)-
  • Card-20(22)-enolide, 3-((O-2,6-dideoxy-3,4-di-O-formyl-beta-D-ribo-hexopyranosyl-(14)-O-2,6-dideoxy-3-O-formyl-beta-D-ribo-hexopyranosyl-(14)-2,6-dideoxy-3-O-formyl-beta-D-ribo-hexopyranosyl)oxy)-16-(
  • Card-20(22)-enolide, 3-[(O-2,6-dideoxy-3,4-di-O-formyl-.beta.-D-ribo-hexopyranosyl-(1.fwdarw.4)-O-2,6-dideoxy-3-O-formyl-.beta.-D-ribo-hexopyranosyl-(1.fwdarw.4)-2,6-dideoxy-3-O-formyl-.beta.-D-ribo-hexopyranosyl)oxy]-16-(formyloxy)-14-hydroxy-, (3.beta.,5.beta.,16.beta.)-