Glycoside

GD032392
Name:
NoneFormula:
C47H74O16Smiles:
CC=C(C)C(=O)O[C@@H]1C[C@H]2[C@]3(C)CC[C@@H](O[C@@H]4C[C@H](OC)[C@H](O[C@@H]5C[C@H](OC)[C@H](O[C@@H]6C[C@H](OC)[C@H](O)[C@H](C)O6)[C@H](C)O5)[C@H](C)O4)CC3=CC[C@]2(O)[C@]2(O)CC[C@](O)(C(C)=O)[C@]12CAglycone:
CC=C(C)C(=O)OC1CC2C3(C)CCC(O)CC3=CCC2(O)C2(O)CCC(O)(C(C)=O)C12CSugarmoiety:
COC1CC(OC2C(C)OC(OC3C(C)OC(O)CC3OC)CC2OC)OC(C)C1OOther Identifiers
Properties
HBA: | 16 | RingCount: | 7 |
HBD: | 4 | FractionCSP3: | 0.87 |
AlogP: | 3.95 | Num_rotatable_bonds: | 12 |
MolWt: | 895.09 | Num_heavy_atoms: | 63 |
TPSA: | 207.36 | NumAromaticRings: | 0 |
Unique Aglycone
AD20778
Formula: C26H38O7
Smiles:
CC=C(C)C(=O)OC1CC2C3(C)CCC(O)CC3=CCC2(O)C2(O)CCC(O)(C(C)=O)C12CHBA: | 7 | RingCount: | 4 |
HBD: | 4 | FractionCSP3: | 0.77 |
AlogP: | 2.35 | Num_rotatable_bonds: | 3 |
MolWt: | 462.58 | Num_heavy_atoms: | 33 |
TPSA: | 124.29 | NumAromaticRings: | 0 |