Glycoside
GD154798
Name:
N-[1-({6-[({4,5-dihydroxy-3-[(1-hydroxyethylidene)amino]-6-(hydroxymethyl)oxan-2-yl}oxy)methyl]-4,5-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl}oxy)-3,4-dihydroxypentan-2-yl]-2-hydroxybutanimidic acidFormula:
C29H52O20N2Smiles:
CCC(O)C(O)=NC(COC1OC(COC2OC(CO)C(O)C(O)C2N=C(C)O)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O)C(O)C(C)OAglycone:
CCC(O)C(O)=NC(CO)C(O)C(C)OSugarmoiety:
CC(O)=NC1C(OCC2OC(O)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 22 | RingCount: | 3 |
| HBD: | 14 | FractionCSP3: | 0.93 |
| AlogP: | -6.73 | Num_rotatable_bonds: | 16 |
| MolWt: | 748.73 | Num_heavy_atoms: | 51 |
| TPSA: | 363.32 | NumAromaticRings: | 0 |
Unique Aglycone
AD61454
Formula: C9H19O5N
Smiles:
CCC(O)C(O)=NC(CO)C(O)C(C)O| HBA: | 6 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.89 |
| AlogP: | -1.18 | Num_rotatable_bonds: | 6 |
| MolWt: | 221.25 | Num_heavy_atoms: | 15 |
| TPSA: | 113.51 | NumAromaticRings: | 0 |
