Glycoside
GD000179
Name:
NoneFormula:
C39H70O7N2Smiles:
O[C@H]1[C@H](O)[C@H](OC[C@@H]2O[C@H](CN(CC3CCCCC3)CC3CCCCC3)[C@H](O)[C@H]2O)O[C@@H]1CN(CC1CCCCC1)CC1CCCCC1Aglycone:
CN(CC1CCCCC1)CC1CCCCC1.CN(CC1CCCCC1)CC1CCCCC1Sugarmoiety:
OC1OC(COC2OC(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | 4.86 | Num_rotatable_bonds: | 15 |
| MolWt: | 679.0 | Num_heavy_atoms: | 48 |
| TPSA: | 115.09 | NumAromaticRings: | 0 |
Unique Aglycone
AD00216
Formula: C15H29N
Smiles:
CN(CC1CCCCC1)CC1CCCCC1| HBA: | 1 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 1.0 |
| AlogP: | 4.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 223.4 | Num_heavy_atoms: | 16 |
| TPSA: | 3.24 | NumAromaticRings: | 0 |
