Glycoside
GD154485
Name:
2-(hydroxymethyl)-5-(2-methylpropyl)-3-[3,4,5-trihydroxy-5-(hydroxymethyl)oxolane-2-carbonyloxy]-3aH-indol-3a-ideFormula:
C19H24O8NSmiles:
CC(C)Cc1ccc2[n-]c(CO)c(OC(=O)C3OC(O)(CO)C(O)C3O)c2c1Aglycone:
CC(C)Cc1ccc2[n-]c(CO)c(OC=O)c2c1Sugarmoiety:
OCC1(O)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -0.81 | Num_rotatable_bonds: | 6 |
| MolWt: | 394.4 | Num_heavy_atoms: | 28 |
| TPSA: | 150.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD61356
Formula: C14H16O3N
Smiles:
CC(C)Cc1ccc2[n-]c(CO)c(OC=O)c2c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.36 |
| AlogP: | 2.02 | Num_rotatable_bonds: | 5 |
| MolWt: | 246.29 | Num_heavy_atoms: | 18 |
| TPSA: | 60.63 | NumAromaticRings: | 2 |
