Glycoside
GD057752
Name:
NoneFormula:
C14H28O6N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)CN2CC[NH2+]CC2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(CN1CC[NH2+]CC1)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.93 |
| AlogP: | -4.17 | Num_rotatable_bonds: | 6 |
| MolWt: | 334.39 | Num_heavy_atoms: | 23 |
| TPSA: | 128.1 | NumAromaticRings: | 0 |
Unique Aglycone
AD28986
Formula: C8H18O2N3
Smiles:
O=C(CN1CC[NH2+]CC1)NCCO| HBA: | 5 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.88 |
| AlogP: | -3.03 | Num_rotatable_bonds: | 4 |
| MolWt: | 188.25 | Num_heavy_atoms: | 13 |
| TPSA: | 69.18 | NumAromaticRings: | 0 |
