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LSM-39243

PropertiesImageOccurences in reactions
MNX_IDMNXM530087Image of MNXM530087
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC29H35N3O5
charge0
mass505.25767
referencechebi:127686
InChIKeyCIRYYAWURCKBQH-CIMSBJEKSA-N
InChIInChI=1S/C29H35N3O5/c1-31-19-27-26(35-3)12-10-23(37-27)13-14-36-25-11-9-20(17-30)15-24(25)29(34)32(2)18-22(16-28(31)33)21-7-5-4-6-8-21/h4-9,11,15,22-23,26-27H,10,12-14,16,18-19H2,1-3H3/t22-,23-,26-,27+/m1/s1
SMILESCO[C@@H]1CC[C@@H]2CCOc3ccc(C#N)cc3C(=O)N(C)C[C@H](c3ccccc3)CC(=O)N(C)C[C@@H]1O2
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:127686
chebi:127686
LSM-39243