Glycoside
...
GD142194

Name:
6-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5-{[({2-[({[5,7,9,11,13,15-hexacarbamoyl-4-(3,5-dicarbamoyl-5-methylpentyl)-15-methylpentadecyl]oxy}carbonyl)amino]ethyl}carbamoyl)oxy]methyl}-7-hydroxy-2-methyl-hexahydro-[1,3]dioxolo[4,5-b]pyran-2-carboxylic acid

Formula:
C55H92O29N10

Smiles:
CC(CC(CCC(CCCOC(O)=NCCN=C(O)OCC1OC2OC(C)(C(=O)O)OC2C(O)C1OC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O)C(CC(CC(CC(CC(CC(C)C(=N)O)C(=N)O)C(=N)O)C(=N)O)C(=N)O)C(=N)O)C(=N)O)C(=N)O

Aglycone:
CC(CC(CCC(CCCOC(O)=NCCN=C(O)OCC1OC2OC(C)(C(=O)O)OC2C(O)C1O)C(CC(CC(CC(CC(CC(C)C(=N)O)C(=N)O)C(=N)O)C(=N)O)C(=N)O)C(=N)O)C(=N)O)C(=N)O

Sugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 39 RingCount: 4
HBD: 27 FractionCSP3: 0.8
AlogP: -0.07 Num_rotatable_bonds: 40
MolWt: 1357.38 Num_heavy_atoms: 94
TPSA: 700.03 NumAromaticRings: 0

Unique Aglycone
AD57230
Formula: C43H72O19N10

Smiles:
CC(CC(CCC(CCCOC(O)=NCCN=C(O)OCC1OC2OC(C)(C(=O)O)OC2C(O)C1O)C(CC(CC(CC(CC(CC(C)C(=N)O)C(=N)O)C(=N)O)C(=N)O)C(=N)O)C(=N)O)C(=N)O)C(=N)O
HBA: 29 RingCount: 2
HBD: 21 FractionCSP3: 0.74
AlogP: 4.28 Num_rotatable_bonds: 34
MolWt: 1033.1 Num_heavy_atoms: 72
TPSA: 541.73 NumAromaticRings: 0

Sugarmoiety
SD00078

OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O