[5-methoxy-2-[(1R,6R)-4-(4-methylpent-3-enyl)-6-phenyl-cyclohex-3-en-1-yl]carbonyl-3-oxidanyl-phenyl] ethanoate

Systemtic Name: [5-methoxy-2-[(1R,6R)-4-(4-methylpent-3-enyl)-6-phenyl-cyclohex-3-en-1-yl]carbonyl-3-oxidanyl-phenyl] ethanoate Openeye Name: [3-hydroxy-5-methoxy-2-[(1R,6R)-4-(4-methylpent-3-enyl)-6-phenyl-cyclohex-3-ene-1-carbonyl]phenyl] acetate CAS Name: acetic acid [3-hydroxy-5-methoxy-2-[[(1R,6R)-4-(4-methylpent-3-enyl)-6-phenyl-1-cyclohex-3-enyl]-oxomethyl]phenyl] ester IUPAC Name: [3-hydroxy-5-methoxy-2-[(1R,6R)-4-(4-methylpent-3-enyl)-6-phenylcyclohex-3-ene-1-carbonyl]phenyl] acetate Traditional Name: acetic acid [3-hydroxy-5-methoxy-2-[(1R,6R)-4-(4-methylpent-3-enyl)-6-phenyl-cyclohex-3-ene-1-carbonyl]phenyl] ester Formula: C28H32O5 MolecularWeight: 448.55068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC1=CCC(C(C1)C2=CC=CC=C2)C(=O)C3=C(C=C(C=C3OC(=O)C)OC)O)C

Isomeric SMILES

CC(=CCCC1=CC[C@H]([C@@H](C1)C2=CC=CC=C2)C(=O)C3=C(C=C(C=C3OC(=O)C)OC)O)C

InChI

InChI=1S/C28H32O5/c1-18(2)9-8-10-20-13-14-23(24(15-20)21-11-6-5-7-12-21)28(31)27-25(30)16-22(32-4)17-26(27)33-19(3)29/h5-7,9,11-13,16-17,23-24,30H,8,10,14-15H2,1-4H3/t23-,24+/m1/s1