Chemical Compound

Taxagifine

CAS Registry Number 81489-69-2
Taxagifine chemical structure
Primary Record

Taxagifine

In stock
7,123 g
Purity
99.3 %
CAS
81489-69-2

Compound Identifiers & Properties

CAS
81489-69-2
PubChem CID
44316472
SMILES
CC(=O)O[C@H]1C[C@@H](C(=C)[C@@H]2[C@@]1([C@H]([C@@H]([C@@]3([C@]4(CO[C@@]3(C(=O)C[C@H]4[C@H]2OC(=O)C)C)C)O)OC(=O)C)OC(=O)C)C)OC(=O)/C=C/C5=CC=CC=C5
Canonical SMILES
C=C1[C@@H](OC(=O)/C=C/c2ccccc2)C[C@H](OC(C)=O)[C@@]2(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@]3(O)[C@@]4(C)CO[C@]3(C)C(=O)C[C@H]4[C@@H](OC(C)=O)[C@H]12

Names & Synonyms

  • Taxagifine
  • Taxagifin
  • RefChem:187558
  • H6F6Z86DFD
  • UNII-H6F6Z86DFD
  • 81489-69-2
  • CHEMBL405007
  • orb1681604
  • SCHEMBL29520283
  • DTXSID801336359
  • NP1501
  • ZINC49792340
  • AKOS032949098
  • NS00093877
  • Q15427896
  • [(1R,2R,3S,4R,5S,6S,8S,10R,11R,12R,15S)-3,4,6,11-tetraacetyloxy-2-hydroxy-1,5,15-trimethyl-9-methylidene-14-oxo-16-oxatetracyclo[10.5.0.02,15.05,10]heptadecan-8-yl] (E)-3-phenylprop-2-enoate
  • 1,4-Ethanobenzo(5,6)cycloocta(1,2-C)furan, 2-propenoic acid deriv.
  • 2-Propenoic acid, 3-phenyl-, (1S,3aR,4R,5R,5aR,7S,9S,9aS,10R,11S,11aR)-5,9,10,11-tetrakis(acetyloxy)tetradecahydro-11a-hydroxy-1,3a,9a-trimethyl-6-methylene-13-oxo-1,4-ethanobenzo(5,6)cycloocta(1,2-C)furan-7-yl ester, (2E)-
  • ((1R,2R,3S,4R,5S,6S,8S,10R,11R,12R,15S)-3,4,6,11-tetraacetyloxy-2-hydroxy-1,5,15-trimethyl-9-methylidene-14-oxo-16-oxatetracyclo(10.5.0.02,15.05,10)heptadecan-8-yl) (E)-3-phenylprop-2-enoate
  • (1R,2R,3S,4R,5S,6S,8S,10R,11R,12R,15S)-3,4,6,11-Tetrakis(acetyloxy)-2-hydroxy-1,5,15-trimethyl-9-methylidene-14-oxo-16-oxatetracyclo(10.5.0.0(2,15).0(5,10))heptadecan-8-yl (2E)-3-phenylprop-2-enoate
  • (1R,2R,3S,4R,5S,6S,8S,10R,11R,12R,15S)-3,4,6,11-tetrakis(acetyloxy)-2-hydroxy-1,5,15-trimethyl-9-methylidene-14-oxo-16-oxatetracyclo[10.5.0.0{2,15}.0{5,10}]heptadecan-8-yl (2E)-3-phenylprop-2-enoate
  • 2-PROPENOIC ACID, 3-PHENYL-, 5,9,10,11-TETRAKIS(ACETYLOXY)TETRADECAHYDRO-11A-HYDROXY-1,3A,9A-TRIMETHYL-6-METHYLENE-13-OXO-1,4-ETHANOBENZO(5,6)CYCLOOCTA(1,2-C)FURAN-7-YL ESTER, (1S-(1.ALPHA.,3A.BETA.,4.ALPHA.,5.ALPHA.,5A.BETA.,7.ALPHA.(E),9.BETA.,9A.BETA.,10.ALPHA.,11.BETA.,11A.BETA.))-