Glycoside
GD128332
Name:
2-({7-[6-(hydroxymethyl)-2H-1,3-benzodioxol-5-yl]-1-methyl-1H-indol-6-yl}oxy)-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triolFormula:
C29H35O13NSmiles:
CC1OC(OCC2OC(Oc3ccc4ccn(C)c4c3-c3cc4c(cc3CO)OCO4)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
Cn1ccc2ccc(O)c(-c3cc4c(cc3CO)OCO4)c21Sugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.52 |
| AlogP: | -0.9 | Num_rotatable_bonds: | 7 |
| MolWt: | 605.59 | Num_heavy_atoms: | 43 |
| TPSA: | 201.92 | NumAromaticRings: | 3 |
Unique Aglycone
AD51983
Formula: C17H15O4N
Smiles:
Cn1ccc2ccc(O)c(-c3cc4c(cc3CO)OCO4)c21| HBA: | 5 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.18 |
| AlogP: | 2.77 | Num_rotatable_bonds: | 2 |
| MolWt: | 297.31 | Num_heavy_atoms: | 22 |
| TPSA: | 63.85 | NumAromaticRings: | 3 |
