Glycoside
GD137995
Name:
15-[(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-16-ethyl-5,7,9-trimethyl-1-oxacyclohexadeca-3,11,13-triene-2,10-dioneFormula:
C35H57O11NSmiles:
CCC1OC(=O)C=CC(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)CC(C)C(=O)C=CC=CC1OC1OC(C)C(O)C(OC)C1OAglycone:
CCC1OC(=O)C=CC(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)CC(C)C(=O)C=CC=CC1OSugarmoiety:
COC1C(O)C(C)OC(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.77 |
| AlogP: | 2.54 | Num_rotatable_bonds: | 7 |
| MolWt: | 667.84 | Num_heavy_atoms: | 47 |
| TPSA: | 153.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD55723
Formula: C28H45O7N
Smiles:
CCC1OC(=O)C=CC(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)CC(C)C(=O)C=CC=CC1O| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.71 |
| AlogP: | 3.03 | Num_rotatable_bonds: | 4 |
| MolWt: | 507.67 | Num_heavy_atoms: | 36 |
| TPSA: | 105.53 | NumAromaticRings: | 0 |
