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Ubrogepant (USAN/INN)

PropertiesImageOccurences in reactions
MNX_IDMNXM161998Image of MNXM161998
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC29H26F3N5O3
charge0
mass549.19877
referencekeggD:D10673
InChIKeyDDOOFTLHJSMHLN-ZQHRPCGSSA-N
InChIInChI=1S/C29H26F3N5O3/c1-16-20(17-6-3-2-4-7-17)11-22(26(39)37(16)15-29(30,31)32)35-25(38)19-10-18-12-28(13-23(18)34-14-19)21-8-5-9-33-24(21)36-27(28)40/h2-10,14,16,20,22H,11-13,15H2,1H3,(H,35,38)(H,33,36,40)/t16-,20-,22+,28+/m1/s1
SMILESC[C@@H]1[C@H](c2ccccc2)C[C@H](NC(=O)c2cnc3c(c2)C[C@@]2(C3)C(=O)Nc3ncccc32)C(=O)N1CC(F)(F)F
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Similar chemical compounds in external resources
IdentifierDescription
kegg.drug:D10673
keggD:D10673
Ubrogepant (USAN/INN)
Ubrelvy (TN)
keggD:M_D10673 secondary/obsolete/fantasy identifier