Glycoside

GD009733
Name:
NoneFormula:
C48H90O12N2Smiles:
C=CCCCCCCCCCN[C@@H]1[C@H](C)[C@H](O)[C@@](C)(O)[C@H](CC)OC(=O)[C@H](C)[C@H](OC2CC(C)(OC)C(O)C(C)O2)[C@H](C)[C@H](OC2OC(C)CC(N(C)C)C2O)[C@@](C)(O)C[C@H]1CAglycone:
C=CCCCCCCCCCNC1C(C)CC(C)(O)C(OC2OC(C)CC(N(C)C)C2O)C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C1CSugarmoiety:
COC1(C)CC(O)OC(C)C1OOther Identifiers
Properties
HBA: | 14 | RingCount: | 3 |
HBD: | 6 | FractionCSP3: | 0.94 |
AlogP: | 5.48 | Num_rotatable_bonds: | 18 |
MolWt: | 887.25 | Num_heavy_atoms: | 62 |
TPSA: | 188.87 | NumAromaticRings: | 0 |
Unique Aglycone
AD07606
Formula: C40H76O9N2
Smiles:
C=CCCCCCCCCCNC1C(C)CC(C)(O)C(OC2OC(C)CC(N(C)C)C2O)C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C1CHBA: | 11 | RingCount: | 2 |
HBD: | 6 | FractionCSP3: | 0.93 |
AlogP: | 4.56 | Num_rotatable_bonds: | 15 |
MolWt: | 729.05 | Num_heavy_atoms: | 51 |
TPSA: | 161.18 | NumAromaticRings: | 0 |