Glycoside
...
GD127185

Name:
5-acetamido-6-[(5-acetamido-4-hydroxy-6-{[hydroxy({hydroxy[(3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl)oxy]phosphoryl}oxy)phosphoryl]oxy}-2-(hydroxymethyl)oxan-3-yl)oxy]-3,4-dihydroxyoxane-2-carboxylic acid

Formula:
C71H116O18N2P2

Smiles:
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)OC1OC(CO)C(OC2OC(C(=O)O)C(O)C(O)C2N=C(C)O)C(O)C1N=C(C)O

Aglycone:
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)O

Sugarmoiety:
CC(O)=NC1C(O)OC(CO)C(OC2OC(C(=O)O)C(O)C(O)C2N=C(C)O)C1O

Other Identifiers

Properties
HBA: 20 RingCount: 2
HBD: 9 FractionCSP3: 0.65
AlogP: 16.15 Num_rotatable_bonds: 43
MolWt: 1347.65 Num_heavy_atoms: 93
TPSA: 313.38 NumAromaticRings: 0

Unique Aglycone
AD24454
Formula: C55H92O7P2

Smiles:
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)O
HBA: 7 RingCount: 0
HBD: 3 FractionCSP3: 0.6
AlogP: 18.44 Num_rotatable_bonds: 35
MolWt: 927.28 Num_heavy_atoms: 64
TPSA: 113.29 NumAromaticRings: 0

Sugarmoiety
SD06743

CC(O)=NC1C(O)OC(CO)C(OC2OC(C(=O)O)C(O)C(O)C2N=C(C)O)C1O