Glycoside

GD126577
Name:
Tenacissoside IFormula:
C44H62O14Smiles:
COC1CC(OC2CCC3(C)C(CCC45OC46CCC(C(C)=O)C6(C)C(OC(C)=O)C(OC(=O)c4ccccc4)C35)C2)OC(C)C1OC1OC(C)C(O)C(OC)C1OAglycone:
CC(=O)OC1C(OC(=O)c2ccccc2)C2C3(C)CCC(O)CC3CCC23OC32CCC(C(C)=O)C12CSugarmoiety:
COC1CC(O)OC(C)C1OC1OC(C)C(O)C(OC)C1OOther Identifiers
Properties
HBA: | 14 | RingCount: | 8 |
HBD: | 2 | FractionCSP3: | 0.8 |
AlogP: | 4.29 | Num_rotatable_bonds: | 10 |
MolWt: | 814.97 | Num_heavy_atoms: | 58 |
TPSA: | 178.04 | NumAromaticRings: | 1 |
Unique Aglycone
AD22635
Formula: C30H38O7
Smiles:
CC(=O)OC1C(OC(=O)c2ccccc2)C2C3(C)CCC(O)CC3CCC23OC32CCC(C(C)=O)C12CHBA: | 7 | RingCount: | 6 |
HBD: | 1 | FractionCSP3: | 0.7 |
AlogP: | 4.25 | Num_rotatable_bonds: | 4 |
MolWt: | 510.63 | Num_heavy_atoms: | 37 |
TPSA: | 102.43 | NumAromaticRings: | 1 |