Glycoside
...
GD122319

Name:
6-({5-[(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy]-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl}oxy)-16-ethyl-15-{[(5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl)oxy]methyl}-5,9,13-trimethyl-2,10-dioxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-4-yl propanoate

Formula:
C49H81O18N

Smiles:
CCC(=O)OC1CC(=O)OC(CC)C(COC2OC(C)C(O)C(OC)C2OC)C=C(C)C=CC(=O)C(C)CC(CC=O)C(OC2OC(C)C(OC3CC(C)(O)C(O)C(C)O3)C(N(C)C)C2O)C1C

Aglycone:
CCC(=O)OC1CC(=O)OC(CC)C(CO)C=C(C)C=CC(=O)C(C)CC(CC=O)C(O)C1C

Sugarmoiety:
CC1OC(O)C(O)C(N(C)C)C1OC1CC(C)(O)C(O)C(C)O1.COC1C(O)OC(C)C(O)C1OC

Other Identifiers

Properties
HBA: 19 RingCount: 4
HBD: 4 FractionCSP3: 0.84
AlogP: 2.79 Num_rotatable_bonds: 15
MolWt: 972.18 Num_heavy_atoms: 68
TPSA: 244.74 NumAromaticRings: 0

Unique Aglycone
AD49276
Formula: C26H40O8

Smiles:
CCC(=O)OC1CC(=O)OC(CC)C(CO)C=C(C)C=CC(=O)C(C)CC(CC=O)C(O)C1C
HBA: 8 RingCount: 1
HBD: 2 FractionCSP3: 0.69
AlogP: 2.94 Num_rotatable_bonds: 6
MolWt: 480.6 Num_heavy_atoms: 34
TPSA: 127.2 NumAromaticRings: 0

Sugarmoiety
SD00097

CC1OC(O)C(O)C(N(C)C)C1OC1CC(C)(O)C(O)C(C)O1.COC1C(O)OC(C)C(O)C1OC