Glycoside
GD154235
Name:
3'-epi-5'-methoxy-k252dFormula:
C26H27O5N3Smiles:
C=Cc1c(C)n(C2OC(C)C(O)C(O)C2OC)c2c1c1c(c3c4ccccc4[nH]c32)CN=C1OAglycone:
C=Cc1c(C)[nH]c2c1c1c(c3c4ccccc4[nH]c23)CN=C1OSugarmoiety:
COC1C(O)OC(C)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 3.7 | Num_rotatable_bonds: | 3 |
| MolWt: | 461.52 | Num_heavy_atoms: | 34 |
| TPSA: | 112.23 | NumAromaticRings: | 4 |
Unique Aglycone
AD61288
Formula: C19H15ON3
Smiles:
C=Cc1c(C)[nH]c2c1c1c(c3c4ccccc4[nH]c23)CN=C1O| HBA: | 4 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.11 |
| AlogP: | 4.57 | Num_rotatable_bonds: | 1 |
| MolWt: | 301.35 | Num_heavy_atoms: | 23 |
| TPSA: | 64.17 | NumAromaticRings: | 4 |
