Glycoside
GD124672
Name:
N-(3-{[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-1,4,5,6-tetrahydroxyhexan-2-yl)acetamideFormula:
C20H37O15NSmiles:
CC(O)=NC(CO)C(OC1OC(CO)C(O)C(O)C1OC1OC(C)C(O)C(O)C1O)C(O)C(O)COAglycone:
CC(O)=NCCOSugarmoiety:
CC1OC(OC2C(OC(O)C(O)C(O)CO)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 2 |
| HBD: | 11 | FractionCSP3: | 0.95 |
| AlogP: | -5.93 | Num_rotatable_bonds: | 11 |
| MolWt: | 531.51 | Num_heavy_atoms: | 36 |
| TPSA: | 271.81 | NumAromaticRings: | 0 |
Unique Aglycone
AD45321
Formula: C4H9O2N
Smiles:
CC(O)=NCCO| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.75 |
| AlogP: | -0.04 | Num_rotatable_bonds: | 2 |
| MolWt: | 103.12 | Num_heavy_atoms: | 7 |
| TPSA: | 52.82 | NumAromaticRings: | 0 |
