Glycoside

GD011693
Name:
NoneFormula:
C36H66O13N2Smiles:
CC[C@@H]1OC(=O)[C@H](C)[C@H](O[C@@H]2C[C@@](C)(OC)[C@H](O)[C@H](C)O2)[C@H](C)[C@H](O[C@@H]2O[C@H](C)C[C@H](N)[C@H]2O)[C@@](C)(OC)C[C@H](C)C(=O)N[C@H](C)[C@H](O)[C@]1(C)OAglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N)C2O)C(C)(OC)CC(C)C(=O)NC(C)C(O)C1(C)OSugarmoiety:
COC1(C)CC(O)OC(C)C1OOther Identifiers
Properties
HBA: | 15 | RingCount: | 3 |
HBD: | 7 | FractionCSP3: | 0.94 |
AlogP: | 1.14 | Num_rotatable_bonds: | 7 |
MolWt: | 734.93 | Num_heavy_atoms: | 51 |
TPSA: | 217.72 | NumAromaticRings: | 0 |
Unique Aglycone
AD08904
Formula: C28H52O10N2
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N)C2O)C(C)(OC)CC(C)C(=O)NC(C)C(O)C1(C)OHBA: | 12 | RingCount: | 2 |
HBD: | 7 | FractionCSP3: | 0.93 |
AlogP: | 0.21 | Num_rotatable_bonds: | 4 |
MolWt: | 576.73 | Num_heavy_atoms: | 40 |
TPSA: | 190.03 | NumAromaticRings: | 0 |