Glycoside

GD012756
Name:
NoneFormula:
C36H66O11N2Smiles:
CO[C@@]1(C)C[C@H](C)C(=O)[C@H](C)CN(C)CCOC(=O)[C@@H](C)[C@H](O[C@H]2C[C@](C)(OC)[C@H](O)[C@@H](C)O2)[C@H](C)[C@@H]1O[C@@H]1O[C@H](C)C[C@H](N(C)C)[C@H]1OAglycone:
COC1(C)CC(C)C(=O)C(C)CN(C)CCOC(=O)C(C)C(O)C(C)C1OC1OC(C)CC(N(C)C)C1OSugarmoiety:
COC1(C)CC(O)OC(C)C1OOther Identifiers
Properties
HBA: | 13 | RingCount: | 3 |
HBD: | 2 | FractionCSP3: | 0.94 |
AlogP: | 2.48 | Num_rotatable_bonds: | 7 |
MolWt: | 702.93 | Num_heavy_atoms: | 49 |
TPSA: | 145.69 | NumAromaticRings: | 0 |
Unique Aglycone
AD09585
Formula: C28H52O8N2
Smiles:
COC1(C)CC(C)C(=O)C(C)CN(C)CCOC(=O)C(C)C(O)C(C)C1OC1OC(C)CC(N(C)C)C1OHBA: | 10 | RingCount: | 2 |
HBD: | 2 | FractionCSP3: | 0.93 |
AlogP: | 1.56 | Num_rotatable_bonds: | 4 |
MolWt: | 544.73 | Num_heavy_atoms: | 38 |
TPSA: | 118.0 | NumAromaticRings: | 0 |