[(4S,6S,8S,10S)-6-methoxy-8-methyl-10-(phenylmethoxymethoxy)tridec-12-en-4-yl] benzoate

Systemtic Name: [(4S,6S,8S,10S)-6-methoxy-8-methyl-10-(phenylmethoxymethoxy)tridec-12-en-4-yl] benzoate Openeye Name: [(1S,3S,5S,7S)-7-(benzyloxymethoxy)-3-methoxy-5-methyl-1-propyl-dec-9-enyl] benzoate CAS Name: benzoic acid [(4S,6S,8S,10S)-6-methoxy-8-methyl-10-(phenylmethoxymethoxy)tridec-12-en-4-yl] ester IUPAC Name: [(4S,6S,8S,10S)-6-methoxy-8-methyl-10-(phenylmethoxymethoxy)tridec-12-en-4-yl] benzoate Traditional Name: benzoic acid [(1S,3S,5S,7S)-7-(benzoxymethoxy)-3-methoxy-5-methyl-1-propyl-dec-9-enyl] ester Formula: C30H42O5 MolecularWeight: 482.65148

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC(CC(C)CC(CC=C)OCOCC1=CC=CC=C1)OC)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCC[C@@H](C[C@H](C[C@H](C)C[C@H](CC=C)OCOCC1=CC=CC=C1)OC)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C30H42O5/c1-5-13-27(34-23-33-22-25-15-9-7-10-16-25)19-24(3)20-29(32-4)21-28(14-6-2)35-30(31)26-17-11-8-12-18-26/h5,7-12,15-18,24,27-29H,1,6,13-14,19-23H2,2-4H3/t24-,27+,28+,29+/m1/s1