Glycoside
GD148989
Name:
1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]cyclopent-2-ene-1-carboxamideFormula:
C18H29O12NSmiles:
CC1OC(OC2C=CC(OC3OC(CO)C(O)C(O)C3O)(C(=N)O)C2)C(O)C(O)C1OAglycone:
N=C(O)C1(O)C=CC(O)C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.83 |
| AlogP: | -3.75 | Num_rotatable_bonds: | 6 |
| MolWt: | 451.43 | Num_heavy_atoms: | 31 |
| TPSA: | 222.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD46871
Formula: C6H9O3N
Smiles:
N=C(O)C1(O)C=CC(O)C1| HBA: | 4 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.43 | Num_rotatable_bonds: | 1 |
| MolWt: | 143.14 | Num_heavy_atoms: | 10 |
| TPSA: | 84.54 | NumAromaticRings: | 0 |
