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Patidegib

PropertiesImageOccurences in reactions
MNX_IDMNXM160983Image of MNXM160983
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC29H48N2O3S
charge0
mass504.33856
referencechebi:177425
InChIKeyHZLFFNCLTRVYJG-WWGOJCOQSA-N
InChIInChI=1S/C29H48N2O3S/c1-17-12-26-27(30-16-17)19(3)29(34-26)11-9-22-23-7-6-20-13-21(31-35(5,32)33)8-10-28(20,4)25(23)14-24(22)18(2)15-29/h17,19-23,25-27,30-31H,6-16H2,1-5H3/t17-,19+,20+,21+,22-,23-,25-,26+,27-,28-,29-/m0/s1
SMILESCC1=C2C[C@H]3[C@@H](CC[C@@H]4C[C@H](NS(C)(=O)=O)CC[C@]34C)[C@@H]2CC[C@@]2(C1)O[C@@H]1C[C@H](C)CN[C@H]1[C@H]2C
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:177425
chebi:177425 		Patidegib
N-[(3R,3'R,3'aS,4aR,6'S,6aR,6bS,7'aR,9S,12aS,12bS)-3',6',11,12b-tetramethylspiro[1,2,3,4,4a,5,6,6a,6b,7,8,10,12,12a-tetradecahydronaphtho[2,1-a]azulene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-uro[3,2-b]pyridine]-3-yl]methanesulonamide
kegg.drug:D10324
keggD:D10324 		Patidegib (USAN)
Saridegib
keggD:M_D10324 secondary/obsolete/fantasy identifier