Glycoside
GD010578
Name:
NoneFormula:
C35H49O10NSmiles:
COC12CCC3(CC1C(C)(O)C(C)(C)C)[C@@H]1Cc4ccc(OC5OC(C(=O)O)[C@H](O)C(O)[C@H]5O)c5c4[C@@]3(CCN1CC1CC1)C2O5Aglycone:
COC12CCC3(CC1C(C)(O)C(C)(C)C)C1Cc4ccc(O)c5c4C3(CCN1CC1CC1)C2O5Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 9 |
| HBD: | 5 | FractionCSP3: | 0.8 |
| AlogP: | 1.98 | Num_rotatable_bonds: | 7 |
| MolWt: | 643.77 | Num_heavy_atoms: | 46 |
| TPSA: | 158.38 | NumAromaticRings: | 1 |
Unique Aglycone
AD08148
Formula: C29H41O4N
Smiles:
COC12CCC3(CC1C(C)(O)C(C)(C)C)C1Cc4ccc(O)c5c4C3(CCN1CC1CC1)C2O5| HBA: | 5 | RingCount: | 8 |
| HBD: | 2 | FractionCSP3: | 0.79 |
| AlogP: | 4.41 | Num_rotatable_bonds: | 4 |
| MolWt: | 467.65 | Num_heavy_atoms: | 34 |
| TPSA: | 62.16 | NumAromaticRings: | 1 |
