Glycoside

GD127890
Name:
2-{[8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C36H60O7Smiles:
CC1(C)CCC2(CO)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1Aglycone:
CC1(C)CCC2(CO)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 7 | RingCount: | 6 |
HBD: | 5 | FractionCSP3: | 0.94 |
AlogP: | 4.97 | Num_rotatable_bonds: | 4 |
MolWt: | 604.87 | Num_heavy_atoms: | 43 |
TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD03266
Formula: C30H50O2
Smiles:
CC1(C)CCC2(CO)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1HBA: | 2 | RingCount: | 5 |
HBD: | 2 | FractionCSP3: | 0.93 |
AlogP: | 7.14 | Num_rotatable_bonds: | 1 |
MolWt: | 442.73 | Num_heavy_atoms: | 32 |
TPSA: | 40.46 | NumAromaticRings: | 0 |