Glycoside

GD116036
Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 2-{6'-ethenyl-2-oxo-1,2,3',5',6',7',8',8'a-octahydro-2'H-spiro[indole-3,1'-indolizin]-7'-yl}-3-methoxyprop-2-enoateFormula:
C27H34O9N2Smiles:
C=CC1CN2CCC3(C(O)=Nc4ccccc43)C2CC1C(=COC)C(=O)OC1OC(CO)C(O)C(O)C1OAglycone:
C=CC1CN2CCC3(C(O)=Nc4ccccc43)C2CC1C(=COC)C(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 11 | RingCount: | 5 |
HBD: | 5 | FractionCSP3: | 0.56 |
AlogP: | 0.3 | Num_rotatable_bonds: | 6 |
MolWt: | 530.57 | Num_heavy_atoms: | 38 |
TPSA: | 161.51 | NumAromaticRings: | 1 |
Unique Aglycone
AD46015
Formula: C21H24O4N2
Smiles:
C=CC1CN2CCC3(C(O)=Nc4ccccc43)C2CC1C(=COC)C(=O)OHBA: | 6 | RingCount: | 4 |
HBD: | 2 | FractionCSP3: | 0.43 |
AlogP: | 3.04 | Num_rotatable_bonds: | 4 |
MolWt: | 368.43 | Num_heavy_atoms: | 27 |
TPSA: | 82.36 | NumAromaticRings: | 1 |