Glycoside
...
GD136651

Name:
10-{[6-({[4-({5-[(4-{[4-({4,5-dihydroxy-6-methyl-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl}oxy)-3,5-dihydroxyoxan-2-yl]oxy}-3,5-dihydroxy-6-methyloxan-2-yl)oxy]-3,4-dihydroxyoxan-2-yl}oxy)-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-3,4-dihydroxy-5-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl]oxy}-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid

Formula:
C74H120O37

Smiles:
CC1OC(OC2C(O)COC(OC3C(O)C(C)OC(OC4COC(OC5C(O)C(CO)OC(OCC6OC(OC7CCC8(C)C(CCC9(C)C8CC=C8C%10CC(C)(C)CCC%10(C(=O)O)CCC89C)C7(C)C)C(O)C(O)C6OC6OCC(O)C(O)C6O)C5O)C(O)C4O)C3O)C2O)C(OC2OCC(O)C(O)C2O)C(O)C1O

Aglycone:
CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1

Sugarmoiety:
CC1OC(OC2C(O)COC(OC3C(O)C(C)OC(OC4COC(OC5C(O)C(CO)OC(OCC6OC(O)C(O)C(O)C6OC6OCC(O)C(O)C6O)C5O)C(O)C4O)C3O)C2O)C(OC2OCC(O)C(O)C2O)C(O)C1O

Other Identifiers

Properties
HBA: 37 RingCount: 13
HBD: 20 FractionCSP3: 0.96
AlogP: -5.56 Num_rotatable_bonds: 19
MolWt: 1601.74 Num_heavy_atoms: 111
TPSA: 569.35 NumAromaticRings: 0

Unique Aglycone
AD00086
Formula: C30H48O3

Smiles:
CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1
HBA: 3 RingCount: 5
HBD: 2 FractionCSP3: 0.9
AlogP: 7.23 Num_rotatable_bonds: 1
MolWt: 456.71 Num_heavy_atoms: 33
TPSA: 57.53 NumAromaticRings: 0

Sugarmoiety
SD08082

CC1OC(OC2C(O)COC(OC3C(O)C(C)OC(OC4COC(OC5C(O)C(CO)OC(OCC6OC(O)C(O)C(O)C6OC6OCC(O)C(O)C6O)C5O)C(O)C4O)C3O)C2O)C(OC2OCC(O)C(O)C2O)C(O)C1O