Glycoside
GD129859
Name:
15-{[5-(dimethylamino)-6-methyloxan-2-yl]oxy}-9-ethyl-16-methyl-2-[(3,4,5-trimethoxy-6-methyloxan-2-yl)oxy]-1H,2H,3H,3aH,5aH,5bH,6H,7H,9H,12H,13H,14H,15H,16H,17H,18aH,18bH-as-indaceno[3,2-d]oxacyclotetradecane-7,17-dioneFormula:
C43H67O10NSmiles:
CCC1C=CCCCC(OC2CCC(N(C)C)C(C)O2)C(C)C(=O)C2=CC3C(C=CC4CC(OC5OC(C)C(OC)C(OC)C5OC)CC43)C2CC(=O)O1Aglycone:
CCC1C=CCCCC(OC2CCC(N(C)C)C(C)O2)C(C)C(=O)C2=CC3C(C=CC4CC(O)CC43)C2CC(=O)O1Sugarmoiety:
COC1C(C)OC(O)C(OC)C1OCOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 0 | FractionCSP3: | 0.81 |
| AlogP: | 6.04 | Num_rotatable_bonds: | 9 |
| MolWt: | 758.01 | Num_heavy_atoms: | 54 |
| TPSA: | 111.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD52608
Formula: C34H51O6N
Smiles:
CCC1C=CCCCC(OC2CCC(N(C)C)C(C)O2)C(C)C(=O)C2=CC3C(C=CC4CC(O)CC43)C2CC(=O)O1| HBA: | 7 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.76 |
| AlogP: | 5.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 569.78 | Num_heavy_atoms: | 41 |
| TPSA: | 85.3 | NumAromaticRings: | 0 |
