9-Undecenoic acid, 11-[(2R,3S)-3-pentyloxiranyl]-, (9E)-rel-

Delta notation: 12,13-O-18:1-delta-9t

Other Names: 9-Undecenoic acid, 11-(3-pentyloxiranyl)-, [2-alpha-(E),3-alpha-]-; (?)-cis-12,13-Epoxy-9(E)-octadecenoic acid; trans-Vernolic acid

Formula: C18 H32 O3

Mass: 296.44

IUPAC name: (E)-11-[(2R,3S)-3-pentyloxiran-2-yl]undec-9-enoic acid

External Database IDs:
CAS registry: 75918-47-7
SOFA Mol: M_337
Lipid Maps: not found
PubChem: 12444770
ChEBI:

inchi: InChI=1/C18H32O3/c1-2-3-10-13-16-17(21-16)14-11-8-6-4-5-7-9-12-15-18(19)20/h8,11,16-17H,2-7,9-10,12-15H2,1H3,(H,19,20)/b11-8+/t16-,17+/m0/s1/f/h19H

stdinchi: InChI=1S/C18H32O3/c1-2-3-10-13-16-17(21-16)14-11-8-6-4-5-7-9-12-15-18(19)20/h8,11,16-17H,2-7,9-10,12-15H2,1H3,(H,19,20)/b11-8+/t16-,17+/m0/s1

stdinchikey: CCPPLLJZDQAOHD-VESHTZQJSA-N

smiles: C(CCCC)[C@H]1[C@H](O1)C/C=C/CCCCCCCC(=O)O