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HIT218679346
  • HIT ID:HIT218679346
  • Cas No:
  • Common Name:2-{[1,2,6,6,10,17-hexamethyl-15-(2-methylprop-1-en-1-yl)-17-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-14-oxapentacyclo[11.7.1.0^{2,11}.0^{5,10}.0^{18,21}]henicosan-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
    Common Name:2-{[1,2,6,6,10,17-hexamethyl-15-(2-methylprop-1-en-1-yl)-17-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-14-oxapentacyclo[11.7.1.0^{2,11}.0^{5,10}.0^{18,21}]henicosan-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
  • IUPAC:2-{[1,2,6,6,10,17-hexamethyl-15-(2-methylprop-1-en-1-yl)-17-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-14-oxapentacyclo[11.7.1.0^{2,11}.0^{5,10}.0^{18,21}]henicosan-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
    IUPAC:2-{[1,2,6,6,10,17-hexamethyl-15-(2-methylprop-1-en-1-yl)-17-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-14-oxapentacyclo[11.7.1.0^{2,11}.0^{5,10}.0^{18,21}]henicosan-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
  • InChI key:OIXGCEPBMJMDRD-UHFFFAOYSA-N
  • Molecular Formula:C47H78O17
  • Molecular Weight:915.124
  • Hydrogen Bond Donor (HBD):
  • Hydrogen Bond Acceptor (HBA):
  • LogP:
  • SMILES:CC(C)=CC1CC(C)(OC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)C2CCC3(C)C2C(CC2C4(C)CCC(OC5OC(CO)C(O)C(O)C5O)C(C)(C)C4CCC32C)O1
    SMILES:CC(C)=CC1CC(C)(OC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)C2CCC3(C)C2C(CC2C4(C)CCC(OC5OC(CO)C(O)C(O)C5O)C(C)(C)C4CCC32C)O1
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