Glycoside
...
GD158283

Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 10-{[4,5-dihydroxy-6-(hydroxymethyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5-ethoxy-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-carboxylate

Formula:
C50H82O19

Smiles:
CCOC1CC2(C)C(=CCC3C4(C)CCC(OC5OC(CO)C(O)C(O)C5OC5OC(CO)C(O)C(O)C5O)C(C)(C)C4CCC32C)C2CC(C)(C)CCC12C(=O)OC1OC(CO)C(O)C(O)C1O

Aglycone:
CCOC1CC2(C)C(=CCC3C4(C)CCC(O)C(C)(C)C4CCC32C)C2CC(C)(C)CCC12C(=O)O

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 19 RingCount: 8
HBD: 11 FractionCSP3: 0.94
AlogP: 0.16 Num_rotatable_bonds: 11
MolWt: 987.19 Num_heavy_atoms: 69
TPSA: 304.21 NumAromaticRings: 0

Unique Aglycone
AD62494
Formula: C32H52O4

Smiles:
CCOC1CC2(C)C(=CCC3C4(C)CCC(O)C(C)(C)C4CCC32C)C2CC(C)(C)CCC12C(=O)O
HBA: 4 RingCount: 5
HBD: 2 FractionCSP3: 0.91
AlogP: 7.25 Num_rotatable_bonds: 3
MolWt: 500.76 Num_heavy_atoms: 36
TPSA: 66.76 NumAromaticRings: 0

Sugarmoiety
SD00069

OCC1OC(O)C(O)C(O)C1O.OCC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1O