(4S)-5-[4-[3-[4-[(E)-3-ethyl-3-oxidanyl-pent-1-enyl]-2-propyl-phenyl]pentan-3-yl]-2-methyl-phenoxy]-4-oxidanyl-pentanoic acid

Systemtic Name: (4S)-5-[4-[3-[4-[(E)-3-ethyl-3-oxidanyl-pent-1-enyl]-2-propyl-phenyl]pentan-3-yl]-2-methyl-phenoxy]-4-oxidanyl-pentanoic acid Openeye Name: (4S)-5-[4-[1-ethyl-1-[4-[(E)-3-ethyl-3-hydroxy-pent-1-enyl]-2-propyl-phenyl]propyl]-2-methyl-phenoxy]-4-hydroxy-pentanoic acid CAS Name: (4S)-5-[4-[3-[4-[(E)-3-ethyl-3-hydroxypent-1-enyl]-2-propylphenyl]pentan-3-yl]-2-methylphenoxy]-4-hydroxypentanoic acid IUPAC Name: (4S)-5-[4-[3-[4-[(E)-3-ethyl-3-hydroxypent-1-enyl]-2-propylphenyl]pentan-3-yl]-2-methylphenoxy]-4-hydroxypentanoic acid Traditional Name: (4S)-5-[4-[1-ethyl-1-[4-[(E)-3-ethyl-3-hydroxy-pent-1-enyl]-2-propyl-phenyl]propyl]-2-methyl-phenoxy]-4-hydroxy-valeric acid Formula: C33H48O5 MolecularWeight: 524.73122

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)C=CC(CC)(CC)O)C(CC)(CC)C2=CC(=C(C=C2)OCC(CCC(=O)O)O)C

Isomeric SMILES

CCCC1=C(C=CC(=C1)/C=C/C(CC)(CC)O)C(CC)(CC)C2=CC(=C(C=C2)OC[C@H](CCC(=O)O)O)C

InChI

InChI=1S/C33H48O5/c1-7-12-26-22-25(19-20-32(37,8-2)9-3)13-16-29(26)33(10-4,11-5)27-14-17-30(24(6)21-27)38-23-28(34)15-18-31(35)36/h13-14,16-17,19-22,28,34,37H,7-12,15,18,23H2,1-6H3,(H,35,36)/b20-19+/t28-/m0/s1