Glycoside

GD007183
Name:
NAMONIN DFormula:
C46H70O19Smiles:
C=C1CO[C@]2(O[C@@H]3C[C@@H]4[C@@H]5CC=C6C[C@H](O)C[C@H](O[C@@H]7OC[C@H](O)[C@H](O)[C@H]7O[C@@H]7O[C@H](C)[C@H](OC(C)=O)[C@H](O)[C@H]7O)[C@@]6(C)[C@H]5CC[C@@]4(C)[C@H]3[C@H]2C)[C@H](O)[C@H]1O[C@@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1OAglycone:
C=C1COC2(OC3CC4C5CC=C6CC(O)CC(O)C6(C)C5CCC4(C)C3C2C)C(O)C1OSugarmoiety:
CC(=O)OC1C(C)OC(OC2C(O)OCC(O)C2O)C(O)C1O.CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 19 | RingCount: | 9 |
HBD: | 9 | FractionCSP3: | 0.89 |
AlogP: | -0.72 | Num_rotatable_bonds: | 7 |
MolWt: | 927.05 | Num_heavy_atoms: | 65 |
TPSA: | 282.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD01971
Formula: C27H40O6
Smiles:
C=C1COC2(OC3CC4C5CC=C6CC(O)CC(O)C6(C)C5CCC4(C)C3C2C)C(O)C1OHBA: | 6 | RingCount: | 6 |
HBD: | 4 | FractionCSP3: | 0.85 |
AlogP: | 2.55 | Num_rotatable_bonds: | 0 |
MolWt: | 460.61 | Num_heavy_atoms: | 33 |
TPSA: | 99.38 | NumAromaticRings: | 0 |