Glycoside
...
GD115510

Name:
6-({[3,4-dihydroxy-6-(hydroxymethyl)-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl 11,12-dihydroxy-10-(hydroxymethyl)-1,2,10,13a-tetramethyl-1H,2H,3H,4H,4aH,5H,6H,7H,8H,9H,9aH,10H,11H,12H,13H,13aH,13bH,14H,15bH-cyclopropa[i]picene-4a-carboxylate

Formula:
C47H74O19

Smiles:
CC1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC34CC35CCC3C(C)(CO)C(O)C(O)CC3(C)C5CC=C4C2C1C

Aglycone:
CC1CCC2(C(=O)O)CCC34CC35CCC3C(C)(CO)C(O)C(O)CC3(C)C5CC=C4C2C1C

Sugarmoiety:
CC1OC(OC2C(CO)OC(OCC3OC(O)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 19 RingCount: 9
HBD: 12 FractionCSP3: 0.94
AlogP: -1.67 Num_rotatable_bonds: 9
MolWt: 943.09 Num_heavy_atoms: 66
TPSA: 315.21 NumAromaticRings: 0

Unique Aglycone
AD45707
Formula: C29H44O5

Smiles:
CC1CCC2(C(=O)O)CCC34CC35CCC3C(C)(CO)C(O)C(O)CC3(C)C5CC=C4C2C1C
HBA: 5 RingCount: 6
HBD: 4 FractionCSP3: 0.9
AlogP: 4.4 Num_rotatable_bonds: 2
MolWt: 472.67 Num_heavy_atoms: 34
TPSA: 97.99 NumAromaticRings: 0

Sugarmoiety
SD00047

CC1OC(OC2C(CO)OC(OCC3OC(O)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O