Glycoside
GD018045
Name:
Minutoside AFormula:
C32H54O12SSmiles:
CC(C)[C@H](C=C[C@H](C)[C@@H]1C[C@H](O)[C@H]2[C@@]1(C)CC[C@H]1[C@@]2(O)C[C@H](O)[C@@H]2C[C@H](OS(=O)(=O)O)CC[C@]21C)O[C@@H]1OC[C@H](O)[C@H](O)[C@H]1OAglycone:
CC(C)C(O)C=CC(C)C1CC(O)C2C1(C)CCC1C3(C)CCC(OS(=O)(=O)O)CC3C(O)CC12OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 7 | FractionCSP3: | 0.94 |
| AlogP: | 1.56 | Num_rotatable_bonds: | 8 |
| MolWt: | 662.84 | Num_heavy_atoms: | 45 |
| TPSA: | 203.44 | NumAromaticRings: | 0 |
Unique Aglycone
AD12799
Formula: C27H46O8S
Smiles:
CC(C)C(O)C=CC(C)C1CC(O)C2C1(C)CCC1C3(C)CCC(OS(=O)(=O)O)CC3C(O)CC12O| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.93 |
| AlogP: | 3.1 | Num_rotatable_bonds: | 6 |
| MolWt: | 530.72 | Num_heavy_atoms: | 36 |
| TPSA: | 144.52 | NumAromaticRings: | 0 |
