Glycoside
GD124779
Name:
10,14-dihydroxy-6-methyl-7-(5-oxo-2,5-dihydrofuran-3-yl)-16-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-3-oxapentacyclo[9.7.1.0¹,¹â´.0â´,¹â¹.0â¶,¹â°]nonadecan-2-oneFormula:
C29H40O11Smiles:
CC1OC(OC2CCC34C(=O)OC5CC6(C)C(C7=CC(=O)OC7)CCC6(O)C(CCC3(O)C2)C54)C(O)C(O)C1OAglycone:
CC12CC3OC(=O)C45CCC(O)CC4(O)CCC(C35)C1(O)CCC2C1=CC(=O)OC1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 7 |
| HBD: | 5 | FractionCSP3: | 0.86 |
| AlogP: | 0.09 | Num_rotatable_bonds: | 3 |
| MolWt: | 564.63 | Num_heavy_atoms: | 40 |
| TPSA: | 172.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD50429
Formula: C23H30O7
Smiles:
CC12CC3OC(=O)C45CCC(O)CC4(O)CCC(C35)C1(O)CCC2C1=CC(=O)OC1| HBA: | 7 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.83 |
| AlogP: | 1.23 | Num_rotatable_bonds: | 1 |
| MolWt: | 418.49 | Num_heavy_atoms: | 30 |
| TPSA: | 113.29 | NumAromaticRings: | 0 |
