Glycoside
GD036741
Name:
NoneFormula:
C40H68O8N2Smiles:
CN(C[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)C(=O)N[C@@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@]4(C)CC[C@@H]5OC(C)(C)OC[C@@]5(C)[C@H]4CC[C@@]3(C)[C@@]1(C)CC2Aglycone:
CN(C)C(=O)NC12CCC(C)(C)CC1C1=CCC3C4(C)CCC5OC(C)(C)OCC5(C)C4CCC3(C)C1(C)CC2Sugarmoiety:
OCC(O)C(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.93 |
| AlogP: | 4.75 | Num_rotatable_bonds: | 7 |
| MolWt: | 704.99 | Num_heavy_atoms: | 50 |
| TPSA: | 151.95 | NumAromaticRings: | 0 |
Unique Aglycone
AD23175
Formula: C35H58O3N2
Smiles:
CN(C)C(=O)NC12CCC(C)(C)CC1C1=CCC3C4(C)CCC5OC(C)(C)OCC5(C)C4CCC3(C)C1(C)CC2| HBA: | 5 | RingCount: | 6 |
| HBD: | 1 | FractionCSP3: | 0.91 |
| AlogP: | 7.94 | Num_rotatable_bonds: | 1 |
| MolWt: | 554.86 | Num_heavy_atoms: | 40 |
| TPSA: | 50.8 | NumAromaticRings: | 0 |
