Glycoside
GD109424
Name:
NoneFormula:
C40H58O8N4Smiles:
O=C(O[C@@H](CN1CCCCC1)CN1CCCc2ccccc21)[C@H](O)[C@H](O)[C@@](O)(CO)C(=O)O[C@@H](CN1CCCCC1)CN1CCCc2ccccc21Aglycone:
c1ccc2c(c1)CCCN2CCCN1CCCCC1.c1ccc2c(c1)CCCN2CCCN1CCCCC1Sugarmoiety:
O=C(OO)C(O)C(O)C(O)(CO)C(=O)OOOther Identifiers
Properties
| HBA: | 12 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 15 |
| MolWt: | 722.92 | Num_heavy_atoms: | 52 |
| TPSA: | 146.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD44544
Formula: C17H26N2
Smiles:
c1ccc2c(c1)CCCN2CCCN1CCCCC1| HBA: | 2 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.65 |
| AlogP: | 3.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 258.41 | Num_heavy_atoms: | 19 |
| TPSA: | 6.48 | NumAromaticRings: | 1 |
