Glycoside
...
GD119233

Name:
3-{[5-({3,5-dihydroxy-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-3-hydroxy-6-methyl-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-4,5-dihydroxyoxan-2-yl 7,10-dihydroxy-8-(hydroxymethyl)-2,2,5a,5b,8,11a-hexamethyl-9-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,2H,3H,3aH,4H,5H,5aH,5bH,6H,7H,7aH,8H,9H,10H,11H,11aH,11bH,12H,13bH-cyclopenta[a]chrysene-3a-carboxylate

Formula:
C63H102O31

Smiles:
CC1OC(OC2C(O)COC(OC3C(C)OC(OC4C(OC(=O)C56CCC7(C)C(=CCC8C9(C)CC(O)C(OC%10OC(CO)C(O)C(O)C%10O)C(C)(CO)C9C(O)CC87C)C5CC(C)(C)C6)OCC(O)C4O)C(O)C3OC3OC(C)C(O)C(O)C3O)C2O)C(O)C(O)C1O

Aglycone:
CC1(C)CC2C3=CCC4C5(C)CC(O)C(O)C(C)(CO)C5C(O)CC4(C)C3(C)CCC2(C(=O)O)C1

Sugarmoiety:
CC1OC(OC2C(O)COC(OC3C(C)OC(OC4C(O)OCC(O)C4O)C(O)C3OC3OC(C)C(O)C(O)C3O)C2O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 31 RingCount: 11
HBD: 18 FractionCSP3: 0.95
AlogP: -5.5 Num_rotatable_bonds: 14
MolWt: 1355.48 Num_heavy_atoms: 94
TPSA: 491.97 NumAromaticRings: 0

Unique Aglycone
AD47733
Formula: C29H46O6

Smiles:
CC1(C)CC2C3=CCC4C5(C)CC(O)C(O)C(C)(CO)C5C(O)CC4(C)C3(C)CCC2(C(=O)O)C1
HBA: 6 RingCount: 5
HBD: 5 FractionCSP3: 0.9
AlogP: 3.76 Num_rotatable_bonds: 2
MolWt: 490.68 Num_heavy_atoms: 35
TPSA: 118.22 NumAromaticRings: 0

Sugarmoiety
SD05409

CC1OC(OC2C(O)COC(OC3C(C)OC(OC4C(O)OCC(O)C4O)C(O)C3OC3OC(C)C(O)C(O)C3O)C2O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1O