Chem
J-GLOBAL ID：200907014391948233   Nikkaji number：J2.182.127F

2α,5α,7β,10β,14β-Pentaacetoxytaxa-4(20),11-diene

2α,5α,7β,10β,14β-ペンタアセトキシタキサ-4(20),11-ジエン
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： C30H42O10
Molecular formula furigana： C30-H42-O10
Molecular weight： 562.656
InChI： InChI=1S/C30H42O10/c1-14-11-22(37-17(4)32)27-28(40-20(7)35)26-15(2)21(36-16(3)31)12-24(39-19(6)34)30(26,10)13-23(38-18(5)33)25(14)29(27,8)9/h21-24,26-28H,2,11-13H2,1,3-10H3/t21-,22-,23-,24-,26-,27-,28-,30+/m0/s1
InChI key： CBHRLBOXHXKOAA-UJHXIBEVSA-N
SMILES： CC(=O)O[C@H]1CC(=C2[C@H](C[C@]3(C)[C@H](C[C@H](OC(=O)C)C(=C)[C@H]3[C@H](OC(=O)C)[C@H]1C2(C)C)OC(=O)C)OC(=O)C)C
Systematic name  (3)：
  • 2α,5α,7β,10β,14β-ペンタアセトキシタキサ-4(20),11-ジエン
  • (1S,2S,3R,5S,7S,8S,10S,14S)-2,5,7,10-テトラキス(アセチルオキシ)-8,12,15,15-テトラメチル-4-メチリデントリシクロ[9.3.1.03,8]ペンタデカ-11-エン-14-イル アセタート
  • (1S,2S,3R,5S,7S,8S,10S,14S)-2,5,7,10-tetrakis(acetyloxy)-8,12,15,15-tetramethyl-4-methylidenetricyclo[9.3.1.03,8]pentadec-11-en-14-yl acetate
Other name (1)：
  • 2α,5α,7β,10β,14β-Pentaacetoxytaxa-4(20),11-diene
Thsaurus map：
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