2,3-bis[[(E)-octadec-9-enoyl]sulfanyl]-2-oxidanyl-butanedioate

Systemtic Name: 2,3-bis[[(E)-octadec-9-enoyl]sulfanyl]-2-oxidanyl-butanedioate Openeye Name: 2-hydroxy-2,3-bis[[(E)-octadec-9-enoyl]sulfanyl]butanedioate CAS Name: 2-hydroxy-2,3-bis[[(E)-1-oxooctadec-9-enyl]thio]butanedioate IUPAC Name: 2-hydroxy-2,3-bis[[(E)-octadec-9-enoyl]sulfanyl]butanedioate Traditional Name: 2-hydroxy-2,3-bis[[(E)-octadec-9-enoyl]thio]succinate Formula: C40H68O7S2-2 MolecularWeight: 725.09372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)SC(C(=O)[O-])C(C(=O)[O-])(O)SC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)SC(C(=O)[O-])C(C(=O)[O-])(O)SC(=O)CCCCCCC/C=C/CCCCCCCC

InChI

InChI=1S/C40H70O7S2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35(41)48-37(38(43)44)40(47,39(45)46)49-36(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,37,47H,3-16,21-34H2,1-2H3,(H,43,44)(H,45,46)/p-2/b19-17+,20-18+