Glycoside

GD005845
Name:
NoneFormula:
C37H67O12NSmiles:
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]2C[C@H](N(C)C)C[C@H](C)O2)[C@@](C)(O)C[C@H](C)C(=O)[C@H](C)[C@H](O)[C@]1(C)OAglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2CC(N(C)C)CC(C)O2)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)OSugarmoiety:
COC1(C)CC(O)OC(C)C1OOther Identifiers
Properties
HBA: | 13 | RingCount: | 3 |
HBD: | 4 | FractionCSP3: | 0.95 |
AlogP: | 2.81 | Num_rotatable_bonds: | 7 |
MolWt: | 717.94 | Num_heavy_atoms: | 50 |
TPSA: | 173.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD04902
Formula: C29H53O9N
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2CC(N(C)C)CC(C)O2)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)OHBA: | 10 | RingCount: | 2 |
HBD: | 4 | FractionCSP3: | 0.93 |
AlogP: | 1.89 | Num_rotatable_bonds: | 4 |
MolWt: | 559.74 | Num_heavy_atoms: | 39 |
TPSA: | 145.99 | NumAromaticRings: | 0 |