Glycoside
...
GD036096

Name:
2-(hydroxymethyl)-6-({3,4,14-trihydroxy-5,5,14-trimethyl-9-methylidenetetracyclo[11.2.1.0¹,¹⁰.0⁴,⁸]hexadecan-6-yl}oxy)oxane-3,4,5-triol

Formula:
C26H42O9

Smiles:
C=C1[C@@H]2C[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)C(C)(C)[C@]2(O)[C@@H](O)C[C@@]23C[C@@H](CC[C@@H]12)[C@@](C)(O)C3

Aglycone:
C=C1C2CCC3CC2(CC(O)C2(O)C1CC(O)C2(C)C)CC3(C)O

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

Other Identifiers

Properties
HBA: 9 RingCount: 5
HBD: 7 FractionCSP3: 0.92
AlogP: -0.17 Num_rotatable_bonds: 3
MolWt: 498.61 Num_heavy_atoms: 35
TPSA: 160.07 NumAromaticRings: 0

Unique Aglycone
AD07786
Formula: C20H32O4

Smiles:
C=C1C2CCC3CC2(CC(O)C2(O)C1CC(O)C2(C)C)CC3(C)O
HBA: 4 RingCount: 4
HBD: 4 FractionCSP3: 0.9
AlogP: 2.0 Num_rotatable_bonds: 0
MolWt: 336.47 Num_heavy_atoms: 24
TPSA: 80.92 NumAromaticRings: 0

Sugarmoiety
SD00003

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