Glycoside
GD128596
Name:
3-Hydroxy-K252DFormula:
C26H23O6N3Smiles:
CC1OC(n2c3ccc(O)cc3c3c4c(c5c6ccccc6[nH]c5c32)CN=C4O)C(O)C(O)C1OAglycone:
OC1=NCc2c1c1c3cc(O)ccc3[nH]c1c1[nH]c3ccccc3c21Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 7 |
| HBD: | 6 | FractionCSP3: | 0.27 |
| AlogP: | 2.95 | Num_rotatable_bonds: | 1 |
| MolWt: | 473.49 | Num_heavy_atoms: | 35 |
| TPSA: | 143.46 | NumAromaticRings: | 5 |
Unique Aglycone
AD52092
Formula: C20H13O2N3
Smiles:
OC1=NCc2c1c1c3cc(O)ccc3[nH]c1c1[nH]c3ccccc3c21| HBA: | 5 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.05 |
| AlogP: | 4.48 | Num_rotatable_bonds: | 0 |
| MolWt: | 327.34 | Num_heavy_atoms: | 25 |
| TPSA: | 84.4 | NumAromaticRings: | 5 |
