Glycoside
GD135814
Name:
Macrolactin CFormula:
C30H44O10Smiles:
CC1CCCC=CC=CC(OC2OC(CO)C(O)C(O)C2O)CC(O)CC=CC=CC(O)CC=CC=CC(=O)O1Aglycone:
CC1CCCC=CC=CC(O)CC(O)CC=CC=CC(O)CC=CC=CC(=O)O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.57 |
| AlogP: | 1.52 | Num_rotatable_bonds: | 3 |
| MolWt: | 564.67 | Num_heavy_atoms: | 40 |
| TPSA: | 166.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD04326
Formula: C24H34O5
Smiles:
CC1CCCC=CC=CC(O)CC(O)CC=CC=CC(O)CC=CC=CC(=O)O1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | 3.69 | Num_rotatable_bonds: | 0 |
| MolWt: | 402.53 | Num_heavy_atoms: | 29 |
| TPSA: | 86.99 | NumAromaticRings: | 0 |
