Glycoside
GD132976
Name:
2-{[15-(4,5-dihydroxy-6-methoxy-6-methylheptan-2-yl)-2,6,6,7,10-pentamethylpentacyclo[12.3.1.0¹,¹â´.0²,¹¹.0âµ,¹â°]octadecan-3-yl]oxy}-6-ethyloxane-3,4,5-triolFormula:
C39H68O8Smiles:
CCC1OC(OC2CC3C(C)(C)C(C)CCC3(C)C3CCC45CC4(CCC5C(C)CC(O)C(O)C(C)(C)OC)C23C)C(O)C(O)C1OAglycone:
COC(C)(C)C(O)C(O)CC(C)C1CCC23CC12CCC1C2(C)CCC(C)C(C)(C)C2CC(O)C13CSugarmoiety:
CCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | 5.45 | Num_rotatable_bonds: | 9 |
| MolWt: | 664.97 | Num_heavy_atoms: | 47 |
| TPSA: | 128.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD53832
Formula: C32H56O4
Smiles:
COC(C)(C)C(O)C(O)CC(C)C1CCC23CC12CCC1C2(C)CCC(C)C(C)(C)C2CC(O)C13C| HBA: | 4 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 6.21 | Num_rotatable_bonds: | 6 |
| MolWt: | 504.8 | Num_heavy_atoms: | 36 |
| TPSA: | 69.92 | NumAromaticRings: | 0 |
