Glycoside

GD027056
Name:
NoneFormula:
C43H70O13Smiles:
COC(=O)[C@@H]1O[C@H](O[C@@H]2CC[C@]3(C)[C@H](CC[C@]4(C)[C@H]3CC=C3[C@@H]5CC(C)(C)CC[C@@]5(CO)[C@H](O)C[C@]34C)C2(C)C)[C@H](O[C@@H]2O[C@H](C)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1OAglycone:
CC1(C)CCC2(CO)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1Sugarmoiety:
COC(=O)C1OC(O)C(OC2OC(C)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
HBA: | 13 | RingCount: | 7 |
HBD: | 7 | FractionCSP3: | 0.93 |
AlogP: | 2.97 | Num_rotatable_bonds: | 6 |
MolWt: | 795.02 | Num_heavy_atoms: | 56 |
TPSA: | 204.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD07473
Formula: C30H50O3
Smiles:
CC1(C)CCC2(CO)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1HBA: | 3 | RingCount: | 5 |
HBD: | 3 | FractionCSP3: | 0.93 |
AlogP: | 6.11 | Num_rotatable_bonds: | 1 |
MolWt: | 458.73 | Num_heavy_atoms: | 33 |
TPSA: | 60.69 | NumAromaticRings: | 0 |