Glycoside
GD144059
Name:
2-(hydroxymethyl)-6-({6,6,9-trimethyl-3-pentyl-6H,6aH,7H,10H,10aH-benzo[c]isochromen-1-yl}oxy)oxane-3,4,5-triolFormula:
C27H40O7Smiles:
CCCCCc1cc(OC2OC(CO)C(O)C(O)C2O)c2c(c1)OC(C)(C)C1CC=C(C)CC21Aglycone:
CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.7 |
| AlogP: | 3.21 | Num_rotatable_bonds: | 7 |
| MolWt: | 476.61 | Num_heavy_atoms: | 34 |
| TPSA: | 108.61 | NumAromaticRings: | 1 |
Unique Aglycone
AD57909
Formula: C21H30O2
Smiles:
CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21| HBA: | 2 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.62 |
| AlogP: | 5.74 | Num_rotatable_bonds: | 4 |
| MolWt: | 314.47 | Num_heavy_atoms: | 23 |
| TPSA: | 29.46 | NumAromaticRings: | 1 |
