Glycoside

GD027828
Name:
NoneFormula:
C40H76O12N2Smiles:
CC[C@@H]1OC(=O)[C@H](C)[C@H](O[C@@H]2C[C@@](C)(OC)[C@H](OC)[C@H](C)O2)[C@H](C)[C@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@](C)(OC)C[C@H](C)N(C)C[C@H](C)[C@H](O)[C@]1(C)OAglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(OC)CC(C)N(C)CC(C)C(O)C1(C)OSugarmoiety:
COC1C(C)OC(O)CC1(C)OCOther Identifiers
Properties
HBA: | 14 | RingCount: | 3 |
HBD: | 3 | FractionCSP3: | 0.97 |
AlogP: | 3.21 | Num_rotatable_bonds: | 9 |
MolWt: | 777.05 | Num_heavy_atoms: | 54 |
TPSA: | 158.08 | NumAromaticRings: | 0 |
Unique Aglycone
AD13874
Formula: C31H60O9N2
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(OC)CC(C)N(C)CC(C)C(O)C1(C)OHBA: | 11 | RingCount: | 2 |
HBD: | 4 | FractionCSP3: | 0.97 |
AlogP: | 1.63 | Num_rotatable_bonds: | 5 |
MolWt: | 604.83 | Num_heavy_atoms: | 42 |
TPSA: | 141.39 | NumAromaticRings: | 0 |