ethyl (E,2R,3R)-15-methyl-3-oxidanyl-2-[[(1R,4R,5R)-4,6,6-trimethyl-4-oxidanyl-3-bicyclo[3.1.1]heptanylidene]amino]hexadec-4-enoate

Systemtic Name: ethyl (E,2R,3R)-15-methyl-3-oxidanyl-2-[[(1R,4R,5R)-4,6,6-trimethyl-4-oxidanyl-3-bicyclo[3.1.1]heptanylidene]amino]hexadec-4-enoate Openeye Name: ethyl (E,2R,3R)-3-hydroxy-2-[[(1R,2R,5R)-2-hydroxy-2,6,6-trimethyl-norpinan-3-ylidene]amino]-15-methyl-hexadec-4-enoate CAS Name: (E,2R,3R)-3-hydroxy-2-[[(1R,4R,5R)-4-hydroxy-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanylidene]amino]-15-methyl-4-hexadecenoic acid ethyl ester IUPAC Name: ethyl (E,2R,3R)-3-hydroxy-2-[[(1R,4R,5R)-4-hydroxy-4,6,6-trimethyl-3-bicyclo[3.1.1]heptanylidene]amino]-15-methylhexadec-4-enoate Traditional Name: (E,2R,3R)-3-hydroxy-2-[[(1R,2R,5R)-2-hydroxy-2,6,6-trimethyl-norpinan-3-ylidene]amino]-15-methyl-hexadec-4-enoic acid ethyl ester Formula: C29H51NO4 MolecularWeight: 477.71954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C=CCCCCCCCCCC(C)C)O)N=C1CC2CC(C2(C)C)C1(C)O

Isomeric SMILES

CCOC(=O)[C@@H]([C@@H](/C=C/CCCCCCCCCC(C)C)O)N=C1C[C@H]2C[C@@H]([C@@]1(C)O)C2(C)C

InChI

InChI=1S/C29H51NO4/c1-7-34-27(32)26(30-25-20-22-19-24(28(22,4)5)29(25,6)33)23(31)18-16-14-12-10-8-9-11-13-15-17-21(2)3/h16,18,21-24,26,31,33H,7-15,17,19-20H2,1-6H3/b18-16+,30-25?/t22-,23-,24-,26-,29-/m1/s1