1-((2R,3R,4S,5R)-5-(((2R,3R,5S,6R)-3-AMINO-6-(((2S,3R,4R,5S,6R)-3-AMINO-6-(AMINOMETHYL)-4,5-DIHYDROXYTETRAHYDRO-2H-PYRAN-2-YLOXY)METHYL)-4,5-DIHYDROXYTETRAHYDRO-2H-PYRAN-2-YLOXY)METHYL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL)PYRIMIDINE-2,4(1H,3H)-DIONE

CAS No.
1064047-24-0
CCD No.
CCD01268356
Formula
C21H35N5O13
MolWeight
734.688

Basic Information

Product Name: 1-((2R,3R,4S,5R)-5-(((2R,3R,5S,6R)-3-AMINO-6-(((2S,3R,4R,5S,6R)-3-AMINO-6-(AMINOMETHYL)-4,5-DIHYDROXYTETRAHYDRO-2H-PYRAN-2-YLOXY)METHYL)-4,5-DIHYDROXYTETRAHYDRO-2H-PYRAN-2-YLOXY)METHYL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL)PYRIMIDINE-2,4(1H,3H)-DIONE
CAS: 1064047-24-0
English Synonyms: OKEANOS OK-Y-04028 ; OKEANOS OK-Y-04044 ; 1-((2R,3R,4S,5R)-5-(((2R,3R,5S,6R)-3-AMINO-6-(((2S,3R,4R,5S,6R)-3-AMINO-6-(AMINOMETHYL)-4,5-DIHYDROXYTETRAHYDRO-2H-PYRAN-2-YLOXY)METHYL)-4,5-DIHYDROXYTETRAHYDRO-2H-PYRAN-2-YLOXY)METHYL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL)PYRIMIDINE-2,4(1H,3H)-DIONE
MDL Number.: MFCD11656027
H bond acceptor: 26
H bond donor: 7
Smile: N[C@H]1[C@@H](O[C@@H]([C@H](C1O)O)CO[C@H]1O[C@@H]([C@H]([C@@H]([C@H]1N)O)O)CN)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N1C(NC(C=C1)=O)=O)O)O
InChi: InChI=1S/C21H35N5O13/c22-3-6-12(28)15(31)10(23)19(38-6)36-5-8-13(29)16(32)11(24)20(39-8)35-4-7-14(30)17(33)18(37-7)26-2-1-9(27)25-21(26)34/h1-2,6-8,10-20,28-33H,3-5,22-24H2,(H,25,27,34)/t6-,7-,8-,10-,11-,12-,13-,14-,15-,16?,17-,18-,19+,20-/m1/s1
InChiKey: InChIKey=GSTZGCXSTBKZKI-SINYYBMUSA-N

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