Glycoside
...
GD142684

Name:
6,10,10,14,15,21,21-heptamethyl-9-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,24-dioxaheptacyclo[16.5.2.0¹,¹⁵.0²,⁴.0⁵,¹⁴.0⁶,¹¹.0¹⁸,²³]pentacosan-25-one

Formula:
C36H56O9

Smiles:
CC1(C)CCC23CCC4(C)C5(C)CCC6C(C)(C)C(OC7OC(CO)C(O)C(O)C7O)CCC6(C)C5C5OC5C4(OC2=O)C3C1

Aglycone:
CC1(C)CCC23CCC4(C)C5(C)CCC6C(C)(C)C(O)CCC6(C)C5C5OC5C4(OC2=O)C3C1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 8
HBD: 4 FractionCSP3: 0.97
AlogP: 3.72 Num_rotatable_bonds: 3
MolWt: 632.84 Num_heavy_atoms: 45
TPSA: 138.21 NumAromaticRings: 0

Unique Aglycone
AD05043
Formula: C30H46O4

Smiles:
CC1(C)CCC23CCC4(C)C5(C)CCC6C(C)(C)C(O)CCC6(C)C5C5OC5C4(OC2=O)C3C1
HBA: 4 RingCount: 7
HBD: 1 FractionCSP3: 0.97
AlogP: 5.9 Num_rotatable_bonds: 0
MolWt: 470.69 Num_heavy_atoms: 34
TPSA: 59.06 NumAromaticRings: 0

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O