Glycoside

GD121394
Name:
Lmg-2Formula:
C64H120O23N2Smiles:
CCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(COC1OC(CO)C(OC2OC(CO)C(O)C(OC3(C(=O)O)CC(O)C(N=C(C)O)C(C(O)C(O)CO)O3)C2O)C(O)C1O)C(O)C(O)CCCCCCCCCCCC(C)CCAglycone:
CC(O)=NC1C(O)CC(O)(C(=O)O)OC1C(O)C(O)CO.CCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCC(C)CCSugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 25 | RingCount: | 3 |
HBD: | 16 | FractionCSP3: | 0.95 |
AlogP: | 4.82 | Num_rotatable_bonds: | 50 |
MolWt: | 1285.66 | Num_heavy_atoms: | 89 |
TPSA: | 420.85 | NumAromaticRings: | 0 |
Unique Aglycone
AD44972
Formula: C11H19O9N
Smiles:
CC(O)=NC1C(O)CC(O)(C(=O)O)OC1C(O)C(O)COHBA: | 10 | RingCount: | 1 |
HBD: | 7 | FractionCSP3: | 0.82 |
AlogP: | -3.03 | Num_rotatable_bonds: | 5 |
MolWt: | 309.27 | Num_heavy_atoms: | 21 |
TPSA: | 180.27 | NumAromaticRings: | 0 |
AD48712
Formula: C41H83O5N
Smiles:
CCCCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCC(C)CCHBA: | 6 | RingCount: | 0 |
HBD: | 5 | FractionCSP3: | 0.98 |
AlogP: | 11.16 | Num_rotatable_bonds: | 37 |
MolWt: | 670.12 | Num_heavy_atoms: | 47 |
TPSA: | 113.51 | NumAromaticRings: | 0 |