Glycoside
...
GD154610

Name:
5-hydroxy-2-methyl-6-({24,25,31,32-tetrahydroxy-5,23,30-trimethyl-33-[(2-methylbutanoyl)oxy]-9-oxo-19-pentyl-2,4,8,20,22,27,29-heptaoxatetracyclo[26.2.2.1³,⁷.0²¹,²⁶]tritriacontan-6-yl}oxy)-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl 2-methylbutanoate

Formula:
C56H96O24

Smiles:
CCCCCC1CCCCCCCCCC(=O)OC2C(OC3OC(C)C(OC(=O)C(C)CC)C(OC4OC(C)C(O)C(O)C4O)C3O)C(C)OC(OC3C(C)OC(OC4C(O1)OC(C)C(O)C4O)C(O)C3O)C2OC(=O)C(C)CC

Aglycone:
CCC(C)C(=O)O.CCCCCC1CCCCCCCCCC(=O)OC2C(O)C(C)OC(OC3C(C)OC(OC4C(O1)OC(C)C(O)C4O)C(O)C3O)C2OC(=O)C(C)CC

Sugarmoiety:
CC1OC(OC2C(O)C(C)OC(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 24 RingCount: 7
HBD: 8 FractionCSP3: 0.95
AlogP: 2.46 Num_rotatable_bonds: 14
MolWt: 1153.36 Num_heavy_atoms: 80
TPSA: 333.04 NumAromaticRings: 0

Unique Aglycone
AD00363
Formula: C5H10O2

Smiles:
CCC(C)C(=O)O
HBA: 2 RingCount: 0
HBD: 1 FractionCSP3: 0.8
AlogP: 1.12 Num_rotatable_bonds: 2
MolWt: 102.13 Num_heavy_atoms: 7
TPSA: 37.3 NumAromaticRings: 0
AD61387
Formula: C39H68O15

Smiles:
CCCCCC1CCCCCCCCCC(=O)OC2C(O)C(C)OC(OC3C(C)OC(OC4C(O1)OC(C)C(O)C4O)C(O)C3O)C2OC(=O)C(C)CC
HBA: 15 RingCount: 5
HBD: 5 FractionCSP3: 0.95
AlogP: 3.16 Num_rotatable_bonds: 7
MolWt: 776.96 Num_heavy_atoms: 54
TPSA: 209.13 NumAromaticRings: 0

Sugarmoiety
SD00324

CC1OC(OC2C(O)C(C)OC(O)C2O)C(O)C(O)C1O