Glycoside

GD023738
Name:
NoneFormula:
C48H78O15Smiles:
C[C@@H]1O[C@H](O[C@H]2[C@H](CO)O[C@@H](O[C@@H]3CC[C@]4(C)[C@H](CC[C@]5(C)[C@H]4CC=C4[C@@H]6CC(C)(C)CC[C@@]6(C=O)CC[C@]45C)C3(C)C)[C@@H](O[C@@H]3O[C@H](C)[C@H](O)[C@H](O)[C@H]3O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1OAglycone:
CC1(C)CCC2(C=O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1Sugarmoiety:
CC1OC(OC2C(O)OC(CO)C(OC3OC(C)C(O)C(O)C3O)C2O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 15 | RingCount: | 8 |
HBD: | 8 | FractionCSP3: | 0.94 |
AlogP: | 2.88 | Num_rotatable_bonds: | 8 |
MolWt: | 895.14 | Num_heavy_atoms: | 63 |
TPSA: | 234.29 | NumAromaticRings: | 0 |
Unique Aglycone
AD15937
Formula: C30H48O2
Smiles:
CC1(C)CCC2(C=O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1HBA: | 2 | RingCount: | 5 |
HBD: | 1 | FractionCSP3: | 0.9 |
AlogP: | 7.35 | Num_rotatable_bonds: | 1 |
MolWt: | 440.71 | Num_heavy_atoms: | 32 |
TPSA: | 37.3 | NumAromaticRings: | 0 |