(10E,13E,16E)-heptacosa-10,13,16-trienedioic acid

Systemtic Name: (10E,13E,16E)-heptacosa-10,13,16-trienedioic acid Openeye Name: (10E,13E,16E)-heptacosa-10,13,16-trienedioic acid CAS Name: (10E,13E,16E)-heptacosa-10,13,16-trienedioic acid IUPAC Name: (10E,13E,16E)-heptacosa-10,13,16-trienedioic acid Traditional Name: (10E,13E,16E)-heptacosa-10,13,16-trienedioic acid Formula: C27H46O4 MolecularWeight: 434.65174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CCCCC=CCC=CCC=CCCCCCCCCC(=O)O)CCCCC(=O)O

Isomeric SMILES

C(CCCC/C=C/C/C=C/C/C=C/CCCCCCCCC(=O)O)CCCCC(=O)O

InChI

InChI=1S/C27H46O4/c28-26(29)24-22-20-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19-21-23-25-27(30)31/h1-2,5-8H,3-4,9-25H2,(H,28,29)(H,30,31)/b2-1+,7-5+,8-6+