Glycoside
...
GD154443

Name:
Telosmoside A4

Formula:
C49H82O16

Smiles:
CCC(C)C(=O)OC(C)C1(O)CCC2(O)C3CCC4CC(OC5CC(OC)C(OC6CC(OC)C(OC7CC(OC)C(O)C(C)O7)C(C)O6)C(C)O5)CCC4(C)C3CC(OC(C)=O)C12C

Aglycone:
CCC(C)C(=O)OC(C)C1(O)CCC2(O)C3CCC4CC(O)CCC4(C)C3CC(OC(C)=O)C12C

Sugarmoiety:
COC1CC(OC2C(C)OC(OC3C(C)OC(O)CC3OC)CC2OC)OC(C)C1O

Other Identifiers

Properties
HBA: 16 RingCount: 7
HBD: 3 FractionCSP3: 0.96
AlogP: 5.36 Num_rotatable_bonds: 14
MolWt: 927.18 Num_heavy_atoms: 65
TPSA: 196.36 NumAromaticRings: 0

Unique Aglycone
AD45352
Formula: C28H46O7

Smiles:
CCC(C)C(=O)OC(C)C1(O)CCC2(O)C3CCC4CC(O)CCC4(C)C3CC(OC(C)=O)C12C
HBA: 7 RingCount: 4
HBD: 3 FractionCSP3: 0.93
AlogP: 3.76 Num_rotatable_bonds: 5
MolWt: 494.67 Num_heavy_atoms: 35
TPSA: 113.29 NumAromaticRings: 0

Sugarmoiety
SD00437

COC1CC(OC2C(C)OC(OC3C(C)OC(O)CC3OC)CC2OC)OC(C)C1O