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HIT103264083
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HIT103264083
  • HIT ID:HIT103264083
  • Cas No:362472-82-0
  • Common Name:Withanoside VI
  • IUPAC:6-[1-hydroxy-1-(9-hydroxy-9a,11a-dimethyl-7-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl)ethyl]-3,4-dimethyl-5,6-dihydro-2H-pyran-2-one
    IUPAC:6-[1-hydroxy-1-(9-hydroxy-9a,11a-dimethyl-7-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl)ethyl]-3,4-dimethyl-5,6-dihydro-2H-pyran-2-one
  • InChIKey:MKCYAASFWFGIJK-UHFFFAOYSA-N
  • Molecular Formula:C40H62O15
  • Molecular Weight:782.921
  • Hydrogen Bond Donor (HBD):9
  • Hydrogen Bond Acceptor (HBA):14
  • LogP:-0.195
  • SMILES:CC1=C(C)C(=O)OC(C1)C(C)(O)C1CCC2C3CC=C4CC(CC(O)C4(C)C3CCC12C)OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O |c:1,t:19|
    SMILES:CC1=C(C)C(=O)OC(C1)C(C)(O)C1CCC2C3CC=C4CC(CC(O)C4(C)C3CCC12C)OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O |c:1,t:19|
  • Withanoside VI is a useful organic compound for research related to life sciences. The catalog number is T124946 and the CAS number is 362472-82-0.
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