Glycoside

GD029549
Name:
NoneFormula:
C39H73O15NSmiles:
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)CC(O)CO)[C@H]2O)[C@@](C)(O)C[C@H](C)[C@H](O)[C@H](C)[C@H](O)[C@]1(C)OAglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)CC(O)CO)C2O)C(C)(O)CC(C)C(O)C(C)C(O)C1(C)OSugarmoiety:
COC1(C)CC(O)OC(C)C1OOther Identifiers
Properties
HBA: | 16 | RingCount: | 3 |
HBD: | 8 | FractionCSP3: | 0.97 |
AlogP: | 0.3 | Num_rotatable_bonds: | 10 |
MolWt: | 796.01 | Num_heavy_atoms: | 55 |
TPSA: | 237.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD19212
Formula: C31H59O12N
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)CC(O)CO)C2O)C(C)(O)CC(C)C(O)C(C)C(O)C1(C)OHBA: | 13 | RingCount: | 2 |
HBD: | 8 | FractionCSP3: | 0.97 |
AlogP: | -0.62 | Num_rotatable_bonds: | 7 |
MolWt: | 637.81 | Num_heavy_atoms: | 44 |
TPSA: | 209.84 | NumAromaticRings: | 0 |