(4S,5S)-4,5-bis(oxidanyl)-5-(1-oxidanylheptadecyl)cyclopent-2-en-1-one

Systemtic Name: (4S,5S)-4,5-bis(oxidanyl)-5-(1-oxidanylheptadecyl)cyclopent-2-en-1-one Openeye Name: (4S,5S)-4,5-dihydroxy-5-(1-hydroxyheptadecyl)cyclopent-2-en-1-one CAS Name: (4S,5S)-4,5-dihydroxy-5-(1-hydroxyheptadecyl)-1-cyclopent-2-enone IUPAC Name: (4S,5S)-4,5-dihydroxy-5-(1-hydroxyheptadecyl)cyclopent-2-en-1-one Traditional Name: (4S,5S)-4,5-dihydroxy-5-(1-hydroxyheptadecyl)cyclopent-2-en-1-one Formula: C22H40O4 MolecularWeight: 368.5506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(C1(C(C=CC1=O)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC([C@@]1([C@H](C=CC1=O)O)O)O

InChI

InChI=1S/C22H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(23)22(26)20(24)17-18-21(22)25/h17-20,23-24,26H,2-16H2,1H3/t19?,20-,22-/m0/s1