Glycoside
...
GD122668

Name:
(3s,4's,5r,5's,6'r,7r,9e,11s,12s,13e,15e,16as,18s,20ar)-3,3',4,4',5',6',7,8,11,12,16a,17,18,20a-tetradecahydro-4',16a,18-trihydroxy-5',10,12,16,19-pentamethyl-1-oxo-6'-(propan-2-yl)-1h-spiro[3,7-methano[2,6]benzodioxacyclooctadecine-5,2'-pyran]-11-yl 2,6-dideoxy-4-o-(2,6-dideoxy-3-o-methyl-alpha-l-arabino-hexopyranosyl)-3-o-methyl-alpha-l-arabino-hexopyranoside

Formula:
C46H72O14

Smiles:
COC1CC(OC2C(C)=CCC3CC(CC4(CC(O)C(C)C(C(C)C)O4)O3)OC(=O)C3C=C(C)C(O)CC3(O)C(C)=CC=CC2C)OCC1OC1CC(OC)C(O)C(C)O1

Aglycone:
CC1=CC2C(=O)OC3CC(CC=C(C)C(O)C(C)C=CC=C(C)C2(O)CC1O)OC1(C3)CC(O)C(C)C(C(C)C)O1

Sugarmoiety:
COC1CC(O)OCC1OC1CC(OC)C(O)C(C)O1

Other Identifiers

Properties
HBA: 14 RingCount: 6
HBD: 4 FractionCSP3: 0.8
AlogP: 4.8 Num_rotatable_bonds: 7
MolWt: 849.07 Num_heavy_atoms: 60
TPSA: 181.06 NumAromaticRings: 0

Unique Aglycone
AD49452
Formula: C33H50O8

Smiles:
CC1=CC2C(=O)OC3CC(CC=C(C)C(O)C(C)C=CC=C(C)C2(O)CC1O)OC1(C3)CC(O)C(C)C(C(C)C)O1
HBA: 8 RingCount: 4
HBD: 4 FractionCSP3: 0.73
AlogP: 4.12 Num_rotatable_bonds: 1
MolWt: 574.76 Num_heavy_atoms: 41
TPSA: 125.68 NumAromaticRings: 0

Sugarmoiety
SD06021

COC1CC(O)OCC1OC1CC(OC)C(O)C(C)O1