Glycoside
GD131787
Name:
N-({5-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-3,4-dihydroxyoxolan-2-yl}methyl)cyclopentanecarboxamideFormula:
C21H28O5N2Smiles:
O=C(CC1OC(CN=C(O)C2CCCC2)C(O)C1O)N1CCc2ccccc21Aglycone:
CC(=O)N1CCc2ccccc21.CN=C(O)C1CCCC1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.62 |
| AlogP: | 1.6 | Num_rotatable_bonds: | 5 |
| MolWt: | 388.46 | Num_heavy_atoms: | 28 |
| TPSA: | 102.59 | NumAromaticRings: | 1 |
Unique Aglycone
AD21383
Formula: C10H11ON
Smiles:
CC(=O)N1CCc2ccccc21| HBA: | 2 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.3 |
| AlogP: | 1.6 | Num_rotatable_bonds: | 0 |
| MolWt: | 161.2 | Num_heavy_atoms: | 12 |
| TPSA: | 20.31 | NumAromaticRings: | 1 |
AD45312
Formula: C7H13ON
Smiles:
CN=C(O)C1CCCC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.86 |
| AlogP: | 1.76 | Num_rotatable_bonds: | 1 |
| MolWt: | 127.19 | Num_heavy_atoms: | 9 |
| TPSA: | 32.59 | NumAromaticRings: | 0 |
