Glycoside
GD018051
Name:
NoneFormula:
C27H23O8N3Smiles:
COC1C(CO)OC(n2c3ccccc3c3c4c(c5c6ccccc6[nH]c5c32)C(=O)N(O)C4=O)C(O)C1OAglycone:
O=C1c2c(c3c4ccccc4[nH]c3c3[nH]c4ccccc4c23)C(=O)N1OSugarmoiety:
COC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 7 |
| HBD: | 5 | FractionCSP3: | 0.26 |
| AlogP: | 2.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 517.49 | Num_heavy_atoms: | 38 |
| TPSA: | 157.48 | NumAromaticRings: | 5 |
Unique Aglycone
AD12803
Formula: C20H11O3N3
Smiles:
O=C1c2c(c3c4ccccc4[nH]c3c3[nH]c4ccccc4c23)C(=O)N1O| HBA: | 6 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 3.94 | Num_rotatable_bonds: | 0 |
| MolWt: | 341.33 | Num_heavy_atoms: | 26 |
| TPSA: | 89.19 | NumAromaticRings: | 5 |
