Glycoside
GD015039
Name:
NoneFormula:
C45H84O11N2Smiles:
CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)C(=O)N[C@H](COC1OC(C)C(O)C(O)C1O)C(=O)NC(CCC(=O)O)C(=O)OCAglycone:
CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)C(=O)NC(CO)C(=O)NC(CCC(=O)O)C(=O)OCSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.91 |
| AlogP: | 7.64 | Num_rotatable_bonds: | 37 |
| MolWt: | 829.17 | Num_heavy_atoms: | 58 |
| TPSA: | 200.95 | NumAromaticRings: | 0 |
Unique Aglycone
AD10990
Formula: C39H74O7N2
Smiles:
CCCCCCCCCCCCCCC(CCCCCCCCCCCCCC)C(=O)NC(CO)C(=O)NC(CCC(=O)O)C(=O)OC| HBA: | 9 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.9 |
| AlogP: | 8.78 | Num_rotatable_bonds: | 35 |
| MolWt: | 683.03 | Num_heavy_atoms: | 48 |
| TPSA: | 142.03 | NumAromaticRings: | 0 |
