Glycoside

GD152538
Name:
2-(hydroxymethyl)-6-{7',9',13'-trimethyl-5-methylidene-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,â¹.0â´,â¸.0¹³,¹â¸]icosan]-18'-ene-4,14'-dioloxy}oxane-3,4,5-triolFormula:
C33H50O10Smiles:
C=C1COC2(CC1O)OC1CC3C4CC=C5CC(OC6OC(CO)C(O)C(O)C6O)CC(O)C5(C)C4CCC3(C)C1C2CAglycone:
C=C1COC2(CC1O)OC1CC3C4CC=C5CC(O)CC(O)C5(C)C4CCC3(C)C1C2CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 7 |
HBD: | 6 | FractionCSP3: | 0.88 |
AlogP: | 1.4 | Num_rotatable_bonds: | 3 |
MolWt: | 606.75 | Num_heavy_atoms: | 43 |
TPSA: | 158.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD08892
Formula: C27H40O5
Smiles:
C=C1COC2(CC1O)OC1CC3C4CC=C5CC(O)CC(O)C5(C)C4CCC3(C)C1C2CHBA: | 5 | RingCount: | 6 |
HBD: | 3 | FractionCSP3: | 0.85 |
AlogP: | 3.58 | Num_rotatable_bonds: | 0 |
MolWt: | 444.61 | Num_heavy_atoms: | 32 |
TPSA: | 79.15 | NumAromaticRings: | 0 |