Glycoside
GD127699
Name:
12-[(4,5-dihydroxy-6-methyloxan-2-yl)oxy]-14-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-6-hydroxy-5,7,8,11,13,15-hexamethyl-1,9-dioxaspiro[2.13]hexadecane-4,10-dioneFormula:
C34H59O12NSmiles:
CC1CC(N(C)C)C(O)C(OC2C(C)CC3(CO3)C(=O)C(C)C(O)C(C)C(C)OC(=O)C(C)C(OC3CC(O)C(O)C(C)O3)C2C)O1Aglycone:
CC1CC(N(C)C)C(O)C(OC2C(C)CC3(CO3)C(=O)C(C)C(O)C(C)C(C)OC(=O)C(C)C(O)C2C)O1Sugarmoiety:
CC1OC(O)CC(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.94 |
| AlogP: | 1.25 | Num_rotatable_bonds: | 5 |
| MolWt: | 673.84 | Num_heavy_atoms: | 47 |
| TPSA: | 176.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD00597
Formula: C28H49O9N
Smiles:
CC1CC(N(C)C)C(O)C(OC2C(C)CC3(CO3)C(=O)C(C)C(O)C(C)C(C)OC(=O)C(C)C(O)C2C)O1| HBA: | 10 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.93 |
| AlogP: | 1.37 | Num_rotatable_bonds: | 3 |
| MolWt: | 543.7 | Num_heavy_atoms: | 38 |
| TPSA: | 138.29 | NumAromaticRings: | 0 |
