methyl (2S,3S)-2,3-bis(oxidanyl)-2-[(E)-prop-1-enyl]octadecanoate

Systemtic Name: methyl (2S,3S)-2,3-bis(oxidanyl)-2-[(E)-prop-1-enyl]octadecanoate Openeye Name: methyl (2S,3S)-2,3-dihydroxy-2-[(E)-prop-1-enyl]octadecanoate CAS Name: (2S,3S)-2,3-dihydroxy-2-[(E)-prop-1-enyl]octadecanoic acid methyl ester IUPAC Name: methyl (2S,3S)-2,3-dihydroxy-2-[(E)-prop-1-enyl]octadecanoate Traditional Name: (E,2S)-2-hydroxy-2-[(1S)-1-hydroxyhexadecyl]pent-3-enoic acid methyl ester Formula: C22H42O4 MolecularWeight: 370.56648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C(C=CC)(C(=O)OC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCC[C@@H]([C@@](/C=C/C)(C(=O)OC)O)O

InChI

InChI=1S/C22H42O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-20(23)22(25,19-5-2)21(24)26-3/h5,19-20,23,25H,4,6-18H2,1-3H3/b19-5+/t20-,22-/m0/s1