Chem
J-GLOBAL ID：200907049445440808   Nikkaji number：J37.200E

Triptolide

トリプトリド
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： C20H24O6
Molecular formula furigana： C20-H24-O6
Molecular weight： 360.406
InChI： InChI=1S/C20H24O6/c1-8(2)18-13(25-18)14-20(26-14)17(3)5-4-9-10(7-23-15(9)21)11(17)6-12-19(20,24-12)16(18)22/h8,11-14,16,22H,4-7H2,1-3H3/t11-,12-,13-,14-,16+,17-,18-,19+,20+/m0/s1
InChI key： DFBIRQPKNDILPW-CIVMWXNOSA-N
SMILES： CC(C)[C@]12O[C@H]1[C@@H]1O[C@@]31[C@]1(O[C@H]1C[C@H]1C4=C(CC[C@]31C)C(=O)OC4)[C@@H]2O
Systematic name  (3)：
  • トリプトリド
  • (1S,2S,4S,5S,7R,8R,9S,11S,13S)-8-ヒドロキシ-1-メチル-7-(プロパン-2-イル)-3,6,10,16-テトラオキサヘプタシクロ[11.7.0.02,4.02,9.05,7.09,11.014,18]イコサ-14(18)-エン-17-オン
  • (1S,2S,4S,5S,7R,8R,9S,11S,13S)-8-hydroxy-1-methyl-7-(propan-2-yl)-3,6,10,16-tetraoxaheptacyclo[11.7.0.02,4.02,9.05,7.09,11.014,18]icos-14(18)-en-17-one
Other name (4)：
  • Triptolide
  • PG-490
  • (-)-トリプトリド
  • (-)- Triptolide
CAS registry number： 38748-32-2
KEGG COMPOUND： C09204
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