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olodaterol sulphate

PropertiesImage
MNX_IDMNXM1595889 Image of MNXM1595889
referencevmhM:olodsulf
vmhM:olodsulf
formulaC20H24N2O8S
global charge0
mol weight452.485
InChIKeyWFWBNMBOJMUVDA-QGZVFWFLSA-N
InChIInChI=1S/C20H24N2O8S/c1-20(2,9-12-3-5-14(6-4-12)30-31(26,27)28)21-10-17(24)15-7-13(23)8-16-19(15)29-11-18(25)22-16/h3-8,17,21,23-24H,9-11H2,1-2H3,(H,22,25)(H,26,27,28)/t17-/m1/s1
SMILESCC(C)(Cc1ccc(OS(=O)(=O)[O-])cc1)[NH2+]C[C@@H](O)c1cc(O)cc2c1OCC(=O)N2
MNX internals
InChI (mnx)InChI=1/C20H24N2O8S/c1-20(2,9-12-3-5-14(6-4-12)30-31(26,27)28)21-10-17(24)15-7-13(23)8-16-19(15)29-11-18(25)22-16/h3-8,17,21,23-24H,9-11H2,1-2H3,(H,22,25)(H,26,27,28)/t17-/m1/s1 Image of MNXM1595889
SMILES (mnx)[CH3:1][C:20]([CH3:2])([CH2:9][c:12]1[cH:3][cH:5][c:14]([O:30][S:31]([OH:26])(=[O:27])=[O:28])[cH:6][cH:4]1)[NH:21][CH2:10][C@H:17]([c:15]1[cH:7][c:13]([OH:23])[cH:8][c:16]2[c:19]1[O:29][CH2:11][C:18](=[O:25])[NH:22]2)[OH:24]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

vmhM:olodsulf
vmhM:olodsulf
vmhmetabolite:olodsulf
vmhmetabolite:olodsulf
WFWBNMBOJMUVDA-QGZVFWFLSA-N
olodaterol sulphate

vmhM:M_olodsulf
secondary/obsolete/fantasy identifier