Glycoside
...
GD140943

Name:
[(4-{[5-({4-[(3,5-dihydroxy-6-methyloxan-2-yl)oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl}oxy)-3,4-dihydroxy-6-methyloxan-2-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]({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)phosphinic acid

Formula:
C79H132O24P2

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(O)C(OC2OC(C)C(OC3OC(CO)C(O)C(OC4OC(C)C(O)CC4O)C3O)C(O)C2O)C1O

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:
CC1OC(OC2C(O)C(CO)OC(OC3C(C)OC(OC4C(O)C(O)OC(CO)C4O)C(O)C3O)C2O)C(O)CC1O

Other Identifiers

Properties
HBA: 24 RingCount: 4
HBD: 12 FractionCSP3: 0.72
AlogP: 12.83 Num_rotatable_bonds: 45
MolWt: 1527.85 Num_heavy_atoms: 105
TPSA: 369.2 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
SD08638

CC1OC(OC2C(O)C(CO)OC(OC3C(C)OC(OC4C(O)C(O)OC(CO)C4O)C(O)C3O)C2O)C(O)CC1O