CAS |
8022-19-3 |
Structure | |
Synonyms |
Saffron resinoid |
IUPAC Name |
(2Z,4E,6Z,8E,10Z,12E,14Z)-2,6,11,15-Tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioic acid |
Molecular Weight |
328.4 |
Canonical SMILES |
CC(=CC=CC=C(C)C=CC=C(C)C(=O)O)C=CC=C(C)C(=O)O |
InChI |
InChI=1S/C20H24O4/c1-15(11-7-13-17(3)19(21)22)9-5-6-10-16(2)12-8-14-18(4)20(23)24/h5-14H,1-4H3,(H,21,22)(H,23,24)/b6-5+,11-7+,12-8+,15-9-,16-10-,17-13-,18-14- |
InChI Key |
PANKHBYNKQNAHN-JTBLXSOISA-N |
Purity |
95% |
Exact Mass |
328.16745924 |
Isomeric SMILES |
C/C(=C/C=C/C=C(\C=C\C=C(/C(=O)O)\C)/C)/C=C/C=C(\C(=O)O)/C |
Monoisotopic Mass |
328.16745924 |
Topological Polar Surface Area |
74.6 Ų |
For Research Use Only. Not for use in diagnostic or therapeutic procedures.