methyl 2,2,6b,9,9,12a-hexamethyl-6a-[[(E)-3-[2-(methylamino)-5-oxidanyl-phenyl]prop-2-enoyl]oxymethyl]-10-oxidanylidene-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylate

Systemtic Name: methyl 2,2,6b,9,9,12a-hexamethyl-6a-[[(E)-3-[2-(methylamino)-5-oxidanyl-phenyl]prop-2-enoyl]oxymethyl]-10-oxidanylidene-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylate Openeye Name: methyl 6a-[[(E)-3-[5-hydroxy-2-(methylamino)phenyl]prop-2-enoyl]oxymethyl]-2,2,6b,9,9,12a-hexamethyl-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylate CAS Name: 6a-[[(E)-3-[5-hydroxy-2-(methylamino)phenyl]-1-oxoprop-2-enoxy]methyl]-2,2,6b,9,9,12a-hexamethyl-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid methyl ester IUPAC Name: methyl 6a-[[(E)-3-[5-hydroxy-2-(methylamino)phenyl]prop-2-enoyl]oxymethyl]-2,2,6b,9,9,12a-hexamethyl-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylate Traditional Name: 6a-[[(E)-3-[5-hydroxy-2-(methylamino)phenyl]acryloyl]oxymethyl]-10-keto-2,2,6b,9,9,12a-hexamethyl-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid methyl ester Formula: C41H57NO6 MolecularWeight: 659.89438

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1)COC(=O)C=CC6=C(C=CC(=C6)O)NC)C(=O)OC)C

Isomeric SMILES

CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)C)C)C)C2C1)COC(=O)/C=C/C6=C(C=CC(=C6)O)NC)C(=O)OC)C

InChI

InChI=1S/C41H57NO6/c1-36(2)19-20-40(35(46)47-8)21-22-41(25-48-34(45)14-9-26-23-27(43)10-12-30(26)42-7)28(29(40)24-36)11-13-32-38(5)17-16-33(44)37(3,4)31(38)15-18-39(32,41)6/h9-12,14,23,29,31-32,42-43H,13,15-22,24-25H2,1-8H3/b14-9+