(1S,12S,13S,15R,16R)-13-methoxy-15-[(4-methoxyphenyl)methoxymethyl]-16-oxidanyl-2,11,14-trioxabicyclo[10.4.0]hexadec-6-ene-3,10-dione

Systemtic Name: (1S,12S,13S,15R,16R)-13-methoxy-15-[(4-methoxyphenyl)methoxymethyl]-16-oxidanyl-2,11,14-trioxabicyclo[10.4.0]hexadec-6-ene-3,10-dione Openeye Name: (1S,12S,13S,15R,16R)-16-hydroxy-13-methoxy-15-[(4-methoxyphenyl)methoxymethyl]-2,11,14-trioxabicyclo[10.4.0]hexadec-6-ene-3,10-dione CAS Name: (1S,12S,13S,15R,16R)-16-hydroxy-13-methoxy-15-[(4-methoxyphenyl)methoxymethyl]-2,11,14-trioxabicyclo[10.4.0]hexadec-6-ene-3,10-dione IUPAC Name: (1S,12S,13S,15R,16R)-16-hydroxy-13-methoxy-15-[(4-methoxyphenyl)methoxymethyl]-2,11,14-trioxabicyclo[10.4.0]hexadec-6-ene-3,10-dione Traditional Name: (1S,12S,13S,15R,16R)-16-hydroxy-13-methoxy-15-(p-anisyloxymethyl)-2,11,14-trioxabicyclo[10.4.0]hexadec-6-ene-3,10-quinone Formula: C23H30O9 MolecularWeight: 450.4789

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Descriptors Computed from Structure

Canonical SMILES:

COC1C2C(C(C(O1)COCC3=CC=C(C=C3)OC)O)OC(=O)CCC=CCCC(=O)O2

Isomeric SMILES

CO[C@@H]1[C@@H]2[C@H]([C@@H]([C@H](O1)COCC3=CC=C(C=C3)OC)O)OC(=O)CCC=CCCC(=O)O2

InChI

InChI=1S/C23H30O9/c1-27-16-11-9-15(10-12-16)13-29-14-17-20(26)21-22(23(28-2)30-17)32-19(25)8-6-4-3-5-7-18(24)31-21/h3-4,9-12,17,20-23,26H,5-8,13-14H2,1-2H3/t17-,20-,21+,22+,23+/m1/s1