Glycoside
GD079612
Name:
NoneFormula:
C19H37O6N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@@H]2CCC[N@H+](C3CC[NH2+]CC3)C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)C1CCC[NH+](C2CC[NH2+]CC2)C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.95 |
| AlogP: | -4.03 | Num_rotatable_bonds: | 6 |
| MolWt: | 403.52 | Num_heavy_atoms: | 28 |
| TPSA: | 129.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD36386
Formula: C13H27O2N3
Smiles:
O=C(NCCO)C1CCC[NH+](C2CC[NH2+]CC2)C1| HBA: | 5 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.92 |
| AlogP: | -2.88 | Num_rotatable_bonds: | 4 |
| MolWt: | 257.38 | Num_heavy_atoms: | 18 |
| TPSA: | 70.38 | NumAromaticRings: | 0 |
