Glycoside
GD152056
Name:
2-(10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carbonyl)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C36H58O7Smiles:
CC1(C)CCC2(C(=O)C3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1Aglycone:
CC1(C)CCC2(C=O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.92 |
| AlogP: | 4.56 | Num_rotatable_bonds: | 3 |
| MolWt: | 602.85 | Num_heavy_atoms: | 43 |
| TPSA: | 127.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD15937
Formula: C30H48O2
Smiles:
CC1(C)CCC2(C=O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1| HBA: | 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 |
