Glycoside
GD115055
Name:
Methoxy-Macrolactin 3Formula:
C31H46O10Smiles:
COC1C=CC=CCC(O)CC=CC=CC(OC2OC(CO)C(O)C(O)C2O)CC=CC=CC(=O)OC(C)CCC1Aglycone:
COC1C=CC=CCC(O)CC=CC=CC(O)CC=CC=CC(=O)OC(C)CCC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | 2.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 578.7 | Num_heavy_atoms: | 41 |
| TPSA: | 155.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD45447
Formula: C25H36O5
Smiles:
COC1C=CC=CCC(O)CC=CC=CC(O)CC=CC=CC(=O)OC(C)CCC1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.48 |
| AlogP: | 4.35 | Num_rotatable_bonds: | 1 |
| MolWt: | 416.56 | Num_heavy_atoms: | 30 |
| TPSA: | 75.99 | NumAromaticRings: | 0 |
