Chem
J-GLOBAL ID：200907029501943019   Nikkaji number：J37.201C

Thromboxane B2

トロンボキサンB2
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C20H34O6
Molecular formula furigana： C20-H34-O6
Molecular weight： 370.486
InChI： InChI=1S/C20H34O6/c1-2-3-6-9-15(21)12-13-18-16(17(22)14-20(25)26-18)10-7-4-5-8-11-19(23)24/h4,7,12-13,15-18,20-22,25H,2-3,5-6,8-11,14H2,1H3,(H,23,24)/b7-4-,13-12+/t15-,16-,17-,18+,20?/m0/s1
InChI key： XNRNNGPBEPRNAR-JQBLCGNGSA-N
SMILES： CCCCC[C@H](O)/C=C/[C@H]1OC(O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)O
Systematic name  (4)：
  • (5Z,9α,13E,15S)-9,11,15-トリヒドロキシトロンボキサ-5,13-ジエン-1-酸
  • (5Z,13E,15S)-9α,11,15-トリヒドロキシトロンボキサ-5,13-ジエン-1-酸
  • (5Z)-7-[(2R,3S,4S)-4,6-ジヒドロキシ-2-[(1E,3S)-3-ヒドロキシオクタ-1-エン-1-イル]オキサン-3-イル]ヘプタ-5-エン酸
  • (5Z)-7-[(2R,3S,4S)-4,6-dihydroxy-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]oxan-3-yl]hept-5-enoic acid
Other name (7)：
  • トロンボキサンB2
  • TXB2
  • Thromboxane B2
  • (5Z,13E,15S)-9α,11,15-Trihydroxythromboxa-5,13-dien-1-oic acid
  • (5Z,9α,13E,15S)-9,11,15-Trihydroxythromboxa-5,13-diene-1-oic acid
Show all
CAS registry number： 54397-85-2
KEGG COMPOUND： C05963
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