Glycoside
...
GD034192

Name:
NAMONIN A

Formula:
C57H84O26

Smiles:
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]8OC[C@H](O)[C@H](OC(C)=O)[C@H]8O)[C@H]7O[C@@H]7O[C@H](C)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]7OC(C)=O)[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]1O

Aglycone:
C=C1COC2(OC3CC4C5CC=C6CC(O)CC(O)C6(C)C5CCC4(C)C3C2C)C(O)C1O

Sugarmoiety:
CC(=O)OC1C(O)COC(OC2C(O)COC(O)C2OC2OC(C)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C1O.CC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 26 RingCount: 10
HBD: 8 FractionCSP3: 0.86
AlogP: -0.54 Num_rotatable_bonds: 12
MolWt: 1185.27 Num_heavy_atoms: 83
TPSA: 359.34 NumAromaticRings: 0

Unique Aglycone
AD01971
Formula: C27H40O6

Smiles:
C=C1COC2(OC3CC4C5CC=C6CC(O)CC(O)C6(C)C5CCC4(C)C3C2C)C(O)C1O
HBA: 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

Sugarmoiety
SD03150

CC(=O)OC1C(O)COC(OC2C(O)COC(O)C2OC2OC(C)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)C1O.CC1OC(O)C(O)C(O)C1O