(5Z,9β,11β,13E,15S)-9,11,15-Trihydroxythromboxa-5,13-Dien-1-Oic Acid

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Formula C20H34O6
IUPAC Name (z)-7-[(2r,3s,4s,6s)-4,6-dihydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]tetrahydropyran-3-yl]hept-5-enoic acid
Molecular Mass 370.480 g·mol−1
Heat of Formation -1309.4 ± 16.7 kJ·mol−1
Dipole Moment 2.88 ± 1.08 D
Volume 478.71 Å 3
Surface Area 366.21 Å 2
HOMO Energy -9.83 ± 0.55 eV
LUMO Energy 0.49 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-7-[(2r,3s,4s,6s)-4,6-dihydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]-3-tetrahydropyranyl]hept-5-enoic acid
  • (z)-7-[(2r,3s,4s,6s)-4,6-dihydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]oxan-3-yl]hept-5-enoic acid
  • (z)-7-[(2r,3s,4s,6s)-4,6-dihydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]tetrahydropyran-3-yl]hept-5-enoic acid
  • thromboxane b2
InChIKey XNRNNGPBEPRNAR-VTCRGFIFSA-N
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