Glycoside

GD122777
Name:
6-{[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}-1,16,16,20-tetramethyl-3-azapentacyclo[10.8.0.0²,¹â°.0â´,â¹.0¹âµ,²â°]icosa-2(10),4,6,8-tetraen-17-oneFormula:
C30H41O7NSmiles:
COC1C(CO)OC(Oc2ccc3c4c([nH]c3c2)C2(C)C(CCC3C(C)(C)C(=O)CCC32C)C4)C(O)C1OAglycone:
CC1(C)C(=O)CCC2(C)C1CCC1Cc3c([nH]c4cc(O)ccc34)C12CSugarmoiety:
COC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
HBA: | 8 | RingCount: | 6 |
HBD: | 4 | FractionCSP3: | 0.7 |
AlogP: | 3.24 | Num_rotatable_bonds: | 4 |
MolWt: | 527.66 | Num_heavy_atoms: | 38 |
TPSA: | 121.24 | NumAromaticRings: | 2 |
Unique Aglycone
AD49512
Formula: C23H29O2N
Smiles:
CC1(C)C(=O)CCC2(C)C1CCC1Cc3c([nH]c4cc(O)ccc34)C12CHBA: | 3 | RingCount: | 5 |
HBD: | 2 | FractionCSP3: | 0.61 |
AlogP: | 5.11 | Num_rotatable_bonds: | 0 |
MolWt: | 351.49 | Num_heavy_atoms: | 26 |
TPSA: | 53.09 | NumAromaticRings: | 2 |