Glycoside
GD130174
Name:
methyl 22-[(4-amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy]-1,3,26-trihydroxy-12-methyl-10-oxo-6,11,28-trioxatricyclo[22.3.1.0âµ,â·]octacosa-8,14,16,18,20-pentaene-25-carboxylateFormula:
C34H49O13NSmiles:
COC(=O)C1C(O)CC2(O)CC(O)CC3OC3C=CC(=O)OC(C)CC=CC=CC=CC=CC(OC3OC(C)C(O)C(N)C3O)CC1O2Aglycone:
COC(=O)C1C(O)CC2(O)CC(O)CC3OC3C=CC(=O)OC(C)CC=CC=CC=CC=CC(O)CC1O2Sugarmoiety:
CC1OC(O)C(O)C(N)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.65 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 3 |
| MolWt: | 679.76 | Num_heavy_atoms: | 48 |
| TPSA: | 219.99 | NumAromaticRings: | 0 |
Unique Aglycone
AD52746
Formula: C28H38O10
Smiles:
COC(=O)C1C(O)CC2(O)CC(O)CC3OC3C=CC(=O)OC(C)CC=CC=CC=CC=CC(O)CC1O2| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.57 |
| AlogP: | 1.39 | Num_rotatable_bonds: | 1 |
| MolWt: | 534.6 | Num_heavy_atoms: | 38 |
| TPSA: | 155.28 | NumAromaticRings: | 0 |
