Glycoside

GD026025
Name:
NoneFormula:
C43H66O15Smiles:
CC(=O)O[C@@H]1C[C@H](O[C@@H]2CC[C@@]3(C)[C@@H](CC[C@H]4[C@H]3C[C@H](O)[C@]3(C)C(C5=CC(=O)OC5)CC[C@@]43O)C2)O[C@H](C)[C@H]1O[C@@H]1C[C@H](O)[C@H](O[C@@H]2C[C@H](O)[C@H](O)[C@H](C)O2)[C@H](C)O1Aglycone:
CC12CCC(O)CC1CCC1C2CC(O)C2(C)C(C3=CC(=O)OC3)CCC12OSugarmoiety:
CC(=O)OC1CC(O)OC(C)C1OC1CC(O)C(OC2CC(O)C(O)C(C)O2)C(C)O1Other Identifiers
Properties
HBA: | 15 | RingCount: | 8 |
HBD: | 5 | FractionCSP3: | 0.91 |
AlogP: | 2.79 | Num_rotatable_bonds: | 8 |
MolWt: | 822.99 | Num_heavy_atoms: | 58 |
TPSA: | 209.13 | NumAromaticRings: | 0 |
Unique Aglycone
AD02796
Formula: C23H34O5
Smiles:
CC12CCC(O)CC1CCC1C2CC(O)C2(C)C(C3=CC(=O)OC3)CCC12OHBA: | 5 | RingCount: | 5 |
HBD: | 3 | FractionCSP3: | 0.87 |
AlogP: | 2.58 | Num_rotatable_bonds: | 1 |
MolWt: | 390.52 | Num_heavy_atoms: | 28 |
TPSA: | 86.99 | NumAromaticRings: | 0 |