Glycoside
...
GD134850

Name:
7-({6-[({3-[(4-{[4,5-dihydroxy-6-(hydroxymethyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl)oxy]-4,5-dihydroxyoxan-2-yl}oxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-6-(hydroxymethyl)-3',3a,4'',6,9a,11a-hexamethyl-1,3,3a,4,5,5a,6,7,8,9,9a,10,11,11a-tetradecahydrodispiro[cyclopenta[a]phenanthrene-2,2':5',2''-bis(oxolane)]-5''-one

Formula:
C65H104O33

Smiles:
CC1CC2(CC(C)C3(CC4(C)CCC5=C(CCC6C5(C)CCC(OC5OC(COC7OCC(O)C(O)C7OC7OC(CO)C(O)C(OC8OC(CO)C(O)C(O)C8OC8OC(CO)C(O)C(O)C8O)C7OC7OC(C)C(O)C(O)C7O)C(O)C(O)C5O)C6(C)CO)C4(C)C3)O2)OC1=O

Aglycone:
CC1CC2(CC(C)C3(CC4(C)CCC5=C(CCC6C5(C)CCC(O)C6(C)CO)C4(C)C3)O2)OC1=O

Sugarmoiety:
CC1OC(OC2C(OC3C(OCC4OC(O)C(O)C(O)C4O)OCC(O)C3O)OC(CO)C(O)C2OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 33 RingCount: 12
HBD: 18 FractionCSP3: 0.95
AlogP: -5.86 Num_rotatable_bonds: 17
MolWt: 1413.51 Num_heavy_atoms: 98
TPSA: 510.43 NumAromaticRings: 0

Unique Aglycone
AD54548
Formula: C30H46O5

Smiles:
CC1CC2(CC(C)C3(CC4(C)CCC5=C(CCC6C5(C)CCC(O)C6(C)CO)C4(C)C3)O2)OC1=O
HBA: 5 RingCount: 6
HBD: 2 FractionCSP3: 0.9
AlogP: 5.53 Num_rotatable_bonds: 1
MolWt: 486.69 Num_heavy_atoms: 35
TPSA: 75.99 NumAromaticRings: 0

Sugarmoiety
SD05838

CC1OC(OC2C(OC3C(OCC4OC(O)C(O)C(O)C4O)OCC(O)C3O)OC(CO)C(O)C2OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O