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HIT103700026
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HIT103700026
  • HIT ID:HIT103700026
  • Cas No:6251-64-5
  • Common Name:Acolonifloroside K
  • IUPAC:4-[(1R,3aS,5aS,7S,9R,9aR,10R,11aR)-3a,5a,9,10-tetrahydroxy-9a-(hydroxymethyl)-11a-methyl-7-{[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]-2,5-dihydrofuran-2-one
    IUPAC:4-[(1R,3aS,5aS,7S,9R,9aR,10R,11aR)-3a,5a,9,10-tetrahydroxy-9a-(hydroxymethyl)-11a-methyl-7-{[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]-2,5-dihydrofuran-2-one
  • InChIKey:LPMXVESGRSUGHW-RSTGETGLSA-N
  • Molecular Formula:C29H44O12
  • Molecular Weight:584.659
  • Hydrogen Bond Donor (HBD):8
  • Hydrogen Bond Acceptor (HBA):11
  • LogP:-2.782
  • SMILES:C[C@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)C4[C@H](O)C[C@]5(C)[C@H](CC[C@]5(O)C4CC[C@]3(O)C2)C2=CC(=O)OC2)[C@@H](O)[C@@H](O)[C@H]1O |t:33|
    SMILES:C[C@H]1O[C@@H](O[C@H]2C[C@@H](O)[C@]3(CO)C4[C@H](O)C[C@]5(C)[C@H](CC[C@]5(O)C4CC[C@]3(O)C2)C2=CC(=O)OC2)[C@@H](O)[C@@H](O)[C@H]1O |t:33|
  • Acolonifloroside K is a useful organic compound for research related to life sciences. The catalog number is T124526 and the CAS number is 6251-64-5.
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