Glycoside

GD005960
Name:
NoneFormula:
C47H71O18NSmiles:
C[C@H]1C=CC=CC=CC=CC=CC=CC=C[C@@H](O[C@@H]2O[C@H](C)[C@H](O)[C@H](N)[C@H]2O)C[C@@H]2O[C@](O)(C[C@@H](O)C[C@@H](O)[C@@H](O)C(=O)C[C@@H](O)C[C@@H](O)CC(=O)O[C@@H](C)[C@H](C)[C@H]1O)C[C@H](O)[C@@H]2C(=O)OAglycone:
CC1C=CC=CC=CC=CC=CC=CC=CC(O)CC2OC(O)(CC(O)CC(O)C(O)C(=O)CC(O)CC(O)CC(=O)OC(C)C(C)C1O)CC(O)C2C(=O)OSugarmoiety:
CC1OC(O)C(O)C(N)C1OOther Identifiers
Properties
HBA: | 19 | RingCount: | 3 |
HBD: | 13 | FractionCSP3: | 0.64 |
AlogP: | -0.11 | Num_rotatable_bonds: | 3 |
MolWt: | 938.07 | Num_heavy_atoms: | 66 |
TPSA: | 336.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD04980
Formula: C41H60O15
Smiles:
CC1C=CC=CC=CC=CC=CC=CC=CC(O)CC2OC(O)(CC(O)CC(O)C(O)C(=O)CC(O)CC(O)CC(=O)OC(C)C(C)C1O)CC(O)C2C(=O)OHBA: | 15 | RingCount: | 2 |
HBD: | 10 | FractionCSP3: | 0.59 |
AlogP: | 1.07 | Num_rotatable_bonds: | 1 |
MolWt: | 792.92 | Num_heavy_atoms: | 56 |
TPSA: | 271.97 | NumAromaticRings: | 0 |