Glycoside
GD123568
Name:
3H-naphtho[2,3-e]indol-1-yl 3,4,5-trihydroxy-5-(hydroxymethyl)oxolane-2-carboxylateFormula:
C22H19O7NSmiles:
O=C(Oc1c[nH]c2ccc3cc4ccccc4cc3c12)C1OC(O)(CO)C(O)C1OAglycone:
O=COc1c[nH]c2ccc3cc4ccccc4cc3c12Sugarmoiety:
OCC1(O)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.23 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 409.39 | Num_heavy_atoms: | 30 |
| TPSA: | 132.24 | NumAromaticRings: | 4 |
Unique Aglycone
AD47969
Formula: C17H11O2N
Smiles:
O=COc1c[nH]c2ccc3cc4ccccc4cc3c12| HBA: | 3 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 4.01 | Num_rotatable_bonds: | 2 |
| MolWt: | 261.28 | Num_heavy_atoms: | 20 |
| TPSA: | 42.09 | NumAromaticRings: | 4 |
