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Drug Details

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Name:CHEMBL385235
PubChem ID:44338598
Pathway:-
InChI:InChI=1S/C48H78O19/c1-21-10-11-27-44(6,7)29(14-16-45(27,8)24(21)18-28(50)48-22(2)12-17-47(48,59)46(9,67-42(48)58)30-13-15-43(4,5)66-30)64-41-38(65-39-36(56)34(54)31(51)23(3)61-39)33(53)26(20-60-41)63-40-37(57)35(55)32(52)25(19-49)62-40/h18,21-23,25-41,49-57,59H,10-17,19-20H2,1-9H3/b24-18+/t21?,22-,23+,25+,26+,27?,28-,29-,30?,31+,32+,33-,34-,35-,36+,37+,38+,39-,40-,41-,45+,46-,47-,48?/m0/s1
SMILES:OC[C@H]1O[C@@H](O[C@@H]2CO[C@H]([C@@H]([C@H]2O)O[C@@H]2O[C@H](C)[C@H]([C@@H]([C@H]2O)O)O)O[C@H]2CC[C@]3(C(C2(C)C)CCC(/C/3=C\[C@@H](C23[C@@H](C)CC[C@]3(O)[C@](OC2=O)(C)C2CCC(O2)(C)C)O)C)C)[C@@H]([C@H]([C@@H]1O)O)O

Properties:
Formula:C48H78O19Atoms:67
Molecular Weight:959.122Rotatable Bonds:10
H-bond Acceptors:19H-bond Donors:10
logP:0.0668
Targets:
NameUniprot IDSourceReferencesInteraction
C-C chemokine receptor type 5CCR5_HUMANBindingDB-shows
Synonyms:
CHEBI:279183
CHEMBL385235