Glycoside
...
GD143800

Name:
methyl 33-[(3,5-dihydroxy-6-methyl-4-{methyl[(2,3,4,5-tetrahydroxyoxan-2-yl)methyl]amino}oxan-2-yl)oxy]-3,5,6,9,11,17,37,38-octahydroxy-15,16,18-trimethyl-13-oxo-14,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylate

Formula:
C55H87O22N

Smiles:
COC(=O)C1C2CC(OC3OC(C)C(O)C(N(C)CC4(O)OCC(O)C(O)C4O)C3O)C=CC=CC=CC=CC=CC=CC=CC(C)C(O)C(C)C(C)OC(=O)CC(O)CC(O)CCC(O)C(O)CC(O)CC(O2)C(O)C1O

Aglycone:
COC(=O)C1C2CC(O)C=CC=CC=CC=CC=CC=CC=CC(C)C(O)C(C)C(C)OC(=O)CC(O)CC(O)CCC(O)C(O)CC(O)CC(O2)C(O)C1O

Sugarmoiety:
CC1OC(O)C(O)C(N(C)CC2(O)OCC(O)C(O)C2O)C1O

Other Identifiers

Properties
HBA: 23 RingCount: 4
HBD: 14 FractionCSP3: 0.71
AlogP: -1.77 Num_rotatable_bonds: 6
MolWt: 1114.29 Num_heavy_atoms: 78
TPSA: 375.98 NumAromaticRings: 0

Unique Aglycone
AD57815
Formula: C42H64O14

Smiles:
COC(=O)C1C2CC(O)C=CC=CC=CC=CC=CC=CC=CC(C)C(O)C(C)C(C)OC(=O)CC(O)CC(O)CCC(O)C(O)CC(O)CC(O2)C(O)C1O
HBA: 14 RingCount: 2
HBD: 9 FractionCSP3: 0.62
AlogP: 1.63 Num_rotatable_bonds: 1
MolWt: 792.96 Num_heavy_atoms: 56
TPSA: 243.9 NumAromaticRings: 0

Sugarmoiety
SD09009

CC1OC(O)C(O)C(N(C)CC2(O)OCC(O)C(O)C2O)C1O