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Drug Details

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Name:CHEBI:653989
PubChem ID:45266392
Pathway:-
InChI:InChI=1S/C39H40N8O15P2.ClH/c1-57-25-10-5-8-23(16-25)36(52)45-28-30(48)27(18-58-63(53,54)62-64(55,56)61-39-32(50)31(49)38(60-39)46-14-12-22(13-15-46)33(40)51)59-37(28)47-20-44-29-34(42-19-43-35(29)47)41-17-24-9-4-7-21-6-2-3-11-26(21)24;/h2-16,19-20,27-28,30-32,37-39,48-50H,17-18H2,1H3,(H5-,40,41,42,43,45,51,52,53,54,55,56);1H/t27-,28-,30-,31-,32+,37-,38-,39-;/m1./s1
SMILES:COc1cccc(c1)C(=O)N[C@@H]1[C@H](O)[C@H](O[C@H]1n1cnc2c1ncnc2NCc1cccc2c1cccc2)COP(=O)(OP(=O)(O[C@H]1O[C@H]([C@@H]([C@@H]1O)O)[n+]1ccc(cc1)C(=O)N)O)O.[Cl-]

Properties:
Formula:C39H41ClN8O15P2Atoms:65
Molecular Weight:959.188Rotatable Bonds:17
H-bond Acceptors:22H-bond Donors:8
logP:-0.2608
Targets:
Synonyms:
CHEBI:653989
CHEMBL552521