Glycoside
GD150753
Name:
N,N-bis({5-[(cyclopropylcarbamoyl)methyl]-3,4-dihydroxyoxolan-2-yl}methyl)-2-methoxyacetamideFormula:
C23H37O10N3Smiles:
COCC(=O)N(CC1OC(CC(O)=NC2CC2)C(O)C1O)CC1OC(CC(O)=NC2CC2)C(O)C1OAglycone:
CC(O)=NC1CC1.CC(O)=NC1CC1.COCC(=O)N(C)CSugarmoiety:
OC1OC(O)C(O)C1O.OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.87 |
| AlogP: | -1.54 | Num_rotatable_bonds: | 12 |
| MolWt: | 515.56 | Num_heavy_atoms: | 36 |
| TPSA: | 194.1 | NumAromaticRings: | 0 |
Unique Aglycone
AD44101
Formula: C5H11O2N
Smiles:
COCC(=O)N(C)C| HBA: | 3 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.8 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 2 |
| MolWt: | 117.15 | Num_heavy_atoms: | 8 |
| TPSA: | 29.54 | NumAromaticRings: | 0 |
AD45667
Formula: C5H9ON
Smiles:
CC(O)=NC1CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 1 |
| MolWt: | 99.13 | Num_heavy_atoms: | 7 |
| TPSA: | 32.59 | NumAromaticRings: | 0 |
