Glycoside
...
GD122703

Name:
methyl 3-{[5-(acetyloxy)-4,5-dimethylhexa-1,3-dien-2-yl]oxy}-15,16-dihydroxy-9,13-dimethyl-4,10-dioxo-11-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,18-dioxapentacyclo[12.5.0.0¹,⁶.0²,¹⁷.0⁸,¹³]nonadec-11-ene-17-carboxylate

Formula:
C37H50O17

Smiles:
C=C(C=C(C)C(C)(C)OC(C)=O)OC1C(=O)OC2CC3C(C)C(=O)C(OC4OC(CO)C(O)C(O)C4O)=CC3(C)C3C(O)C(O)C4(C(=O)OC)OCC23C14

Aglycone:
C=C(C=C(C)C(C)(C)OC(C)=O)OC1C(=O)OC2CC3C(C)C(=O)C(O)=CC3(C)C3C(O)C(O)C4(C(=O)OC)OCC23C14

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

Other Identifiers

Properties
HBA: 17 RingCount: 6
HBD: 6 FractionCSP3: 0.73
AlogP: -1.06 Num_rotatable_bonds: 9
MolWt: 766.79 Num_heavy_atoms: 54
TPSA: 254.27 NumAromaticRings: 0

Unique Aglycone
AD49473
Formula: C31H40O12

Smiles:
C=C(C=C(C)C(C)(C)OC(C)=O)OC1C(=O)OC2CC3C(C)C(=O)C(O)=CC3(C)C3C(O)C(O)C4(C(=O)OC)OCC23C14
HBA: 12 RingCount: 5
HBD: 3 FractionCSP3: 0.68
AlogP: 1.68 Num_rotatable_bonds: 6
MolWt: 604.65 Num_heavy_atoms: 43
TPSA: 175.12 NumAromaticRings: 0

Sugarmoiety
SD00003

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