(2R,4aS,6aR,6aS,14aS,14bR)-2,4a,6a,6a,9,14a-hexamethyl-10-oxidanyl-11-oxidanylidene-N-(pyridin-3-ylmethyl)-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxamide

Systemtic Name: (2R,4aS,6aR,6aS,14aS,14bR)-2,4a,6a,6a,9,14a-hexamethyl-10-oxidanyl-11-oxidanylidene-N-(pyridin-3-ylmethyl)-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxamide Openeye Name: (2R,4aS,6aR,6aS,14aS,14bR)-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-N-(3-pyridylmethyl)-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxamide CAS Name: (2R,4aS,6aR,6aS,14aS,14bR)-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-N-(3-pyridinylmethyl)-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxamide IUPAC Name: (2R,4aS,6aR,6aS,14aS,14bR)-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-N-(pyridin-3-ylmethyl)-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxamide Traditional Name: (2R,4aS,6aR,6aS,14aS,14bR)-10-hydroxy-11-keto-2,4a,6a,6a,9,14a-hexamethyl-N-(3-pyridylmethyl)-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxamide Formula: C35H44N2O3 MolecularWeight: 540.73546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C=C2C1=CC=C3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C(=O)NCC6=CN=CC=C6)C)C)C)C)O

Isomeric SMILES

CC1=C(C(=O)C=C2C1=CC=C3[C@]2(CC[C@@]4([C@@]3(CC[C@@]5([C@H]4C[C@](CC5)(C)C(=O)NCC6=CN=CC=C6)C)C)C)C)O

InChI

InChI=1S/C35H44N2O3/c1-22-24-9-10-27-33(4,25(24)18-26(38)29(22)39)14-16-35(6)28-19-32(3,12-11-31(28,2)13-15-34(27,35)5)30(40)37-21-23-8-7-17-36-20-23/h7-10,17-18,20,28,39H,11-16,19,21H2,1-6H3,(H,37,40)/t28-,31-,32-,33+,34-,35+/m1/s1