(E)-N-[3,4,5,6-tetrakis(oxidanyl)-1-oxidanylidene-hexan-2-yl]hexatriacont-2-enamide

Systemtic Name: (E)-N-[3,4,5,6-tetrakis(oxidanyl)-1-oxidanylidene-hexan-2-yl]hexatriacont-2-enamide Openeye Name: (E)-N-(1-formyl-2,3,4,5-tetrahydroxy-pentyl)hexatriacont-2-enamide CAS Name: (E)-N-(3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)-2-hexatriacontenamide IUPAC Name: (E)-N-(3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)hexatriacont-2-enamide Traditional Name: (E)-N-(1-formyl-2,3,4,5-tetrahydroxy-pentyl)hexatriacont-2-enamide Formula: C42H81NO6 MolecularWeight: 696.09564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC=CC(=O)NC(C=O)C(C(C(CO)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC/C=C/C(=O)NC(C=O)C(C(C(CO)O)O)O

InChI

InChI=1S/C42H81NO6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-40(47)43-38(36-44)41(48)42(49)39(46)37-45/h34-36,38-39,41-42,45-46,48-49H,2-33,37H2,1H3,(H,43,47)/b35-34+