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Name:CHEMBL235533
PubChem ID:23648225
Pathway:Show KEGG pathways
InChI:InChI=1S/C21H25N7O14P2S/c1-2-10-26-17(22)11-19(27-10)28(6-24-11)21-15(32)13(30)9(41-21)4-39-44(36,37)42-43(34,35)38-3-8-12(29)14(31)16(40-8)20-25-7(5-45-20)18(23)33/h1,5-6,8-9,12-16,21,29-32H,3-4H2,(H2,23,33)(H,34,35)(H,36,37)(H2,22,26,27)/t8-,9-,12-,13-,14-,15-,16?,21-/m1/s1
SMILES:C#Cc1nc(N)c2c(n1)n(cn2)[C@@H]1O[C@@H]([C@H]([C@H]1O)O)COP(=O)(OP(=O)(OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)c1scc(n1)C(=O)N)O)O

Properties:
Formula:C21H25N7O14P2SAtoms:45
Molecular Weight:693.474Rotatable Bonds:11
H-bond Acceptors:22H-bond Donors:8
logP:-1.0416
Targets:
Synonyms:
()-oxazepam hemisuccinate sodium salt
CHEMBL235533
Tiazofurin Adenine Dinucleotide (TAD) Analogue, 31