Glycoside
GD156335
Name:
Beta-D-Glucopyranosyl 17-Hydroxy-Ent-Kaurane-19-Oate-16-O-Beta-D-Glucopyr+Formula:
C32H52O14Smiles:
CC1(C(=O)OC2OC(CO)C(O)C(O)C2O)CCCC2(C)C3CCC4CC3(CCC12)CC4(CO)OC1OC(CO)C(O)C(O)C1OAglycone:
CC1(C(=O)O)CCCC2(C)C3CCC4CC3(CCC12)CC4(O)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 6 |
| HBD: | 9 | FractionCSP3: | 0.97 |
| AlogP: | -1.71 | Num_rotatable_bonds: | 7 |
| MolWt: | 660.75 | Num_heavy_atoms: | 46 |
| TPSA: | 236.06 | NumAromaticRings: | 0 |
Unique Aglycone
AD04617
Formula: C20H32O4
Smiles:
CC1(C(=O)O)CCCC2(C)C3CCC4CC3(CCC12)CC4(O)CO| HBA: | 4 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.95 |
| AlogP: | 3.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 336.47 | Num_heavy_atoms: | 24 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
