Glycoside

GD122209
Name:
Oligostatin CFormula:
C31H55O24NSmiles:
CC1OC(OC2C(CO)OC(OC3C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C(O)C3O)C(O)C2O)C(O)C(O)C1NC1C(O)C(O)C(O)C(CO)C1OAglycone:
NC1C(O)C(O)C(O)C(CO)C1OSugarmoiety:
CC1OC(OC2C(CO)OC(OC3C(CO)OC(OC(C(O)CO)C(O)C(O)C=O)C(O)C3O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 25 | RingCount: | 4 |
HBD: | 18 | FractionCSP3: | 0.97 |
AlogP: | -11.85 | Num_rotatable_bonds: | 16 |
MolWt: | 825.76 | Num_heavy_atoms: | 56 |
TPSA: | 428.39 | NumAromaticRings: | 0 |
Unique Aglycone
AD49231
Formula: C7H15O5N
Smiles:
NC1C(O)C(O)C(O)C(CO)C1OHBA: | 6 | RingCount: | 1 |
HBD: | 7 | FractionCSP3: | 1.0 |
AlogP: | -3.62 | Num_rotatable_bonds: | 1 |
MolWt: | 193.2 | Num_heavy_atoms: | 13 |
TPSA: | 127.17 | NumAromaticRings: | 0 |