Glycoside
GD136914
Name:
(3,4,5,6-tetrahydroxyoxan-2-yl)methyl 2-amino-3-(1H-indol-3-yl)propanoateFormula:
C17H22O7N2Smiles:
NC(Cc1c[nH]c2ccccc12)C(=O)OCC1OC(O)C(O)C(O)C1OAglycone:
COC(=O)C(N)Cc1c[nH]c2ccccc12Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.47 |
| AlogP: | -1.62 | Num_rotatable_bonds: | 5 |
| MolWt: | 366.37 | Num_heavy_atoms: | 26 |
| TPSA: | 158.26 | NumAromaticRings: | 2 |
Unique Aglycone
AD55333
Formula: C12H14O2N2
Smiles:
COC(=O)C(N)Cc1c[nH]c2ccccc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 3 |
| MolWt: | 218.26 | Num_heavy_atoms: | 16 |
| TPSA: | 68.11 | NumAromaticRings: | 2 |
