Showing Metabocard for (5Z,9E,14Z)-(8xi,11R,12S)-11,12-epoxy-8-hydroxyicosa-5,9,14-trienoate (BASm0002708)
Common Name | (5z,9e,14z)-(8xi,11r,12s)-11,12-epoxy-8-hydroxyicosa-5,9,14-trienoate |
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Description | Not Available |
Structure | |
Molecular Formula | C20H31O4 |
Average Mass | 335.46500 |
Monoisotopic Mass | 335.22278 |
IUPAC Name | Not Available |
Traditional Name | Not Available |
CAS Registry Number | Not Available |
SMILES | CCCCC/C=C\C[C@@H]1O[C@@H]1/C=C/C(O)C/C=C\CCCC(=O)[O-] |
InChI Identifier | InChI=1S/C20H32O4/c1-2-3-4-5-6-10-13-18-19(24-18)16-15-17(21)12-9-7-8-11-14-20(22)23/h6-7,9-10,15-19,21H,2-5,8,11-14H2,1H3,(H,22,23)/p-1/b9-7-,10-6-,16-15+/t17?,18-,19+/m0/s1 |
InChI Key | SGTUOBURCVMACZ-CIQDQOFUSA-M |
CHEBI ID | CHEBI:57449 |
HMDB ID | HMDB0062619 |
MiMeDB ID | MMDBc0049089 |
State | Expected Solid |
Water Solubility | Not Available |
logS | Not Available |
pKa (Strongest Acidic) | Not Available |
pKa (Strongest Basic) | Not Available |
Hydrogen Acceptor Count | Not Available |
Hydrogen Donor Count | Not Available |
Rotatable Bond Count | Not Available |
Physiological Charge | Not Available |
Formal Charge | Not Available |
Polarizability | Not Available |