Glycoside
...
GD003792

Name:
None

Formula:
C100H200O9N2S2

Smiles:
CCCCCCCCCCCCCCO[C@H]1[C@H](OCCCCCCCCCCCCCC)[C@@H](OCCCCCCCCCCCCCC)[C@@H](O[C@@H]2O[C@H](CSCCN)[C@H](OCCCCCCCCCCCCCC)[C@H](OCCCCCCCCCCCCCC)[C@H]2OCCCCCCCCCCCCCC)O[C@H]1CSCCN

Aglycone:
CCCCCCCCCCCCCCO.CCCCCCCCCCCCCCO.CCCCCCCCCCCCCCO.CCCCCCCCCCCCCCO.CCCCCCCCCCCCCCO.CCCCCCCCCCCCCCO.CSCCN.CSCCN

Sugarmoiety:
OC1OC(OC2OC(O)C(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 2
HBD: 4 FractionCSP3: 1.0
AlogP: 30.35 Num_rotatable_bonds: 94
MolWt: 1638.84 Num_heavy_atoms: 113
TPSA: 135.11 NumAromaticRings: 0

Unique Aglycone
AD00065
Formula: C14H30O

Smiles:
CCCCCCCCCCCCCCO
HBA: 1 RingCount: 0
HBD: 1 FractionCSP3: 1.0
AlogP: 4.68 Num_rotatable_bonds: 12
MolWt: 214.39 Num_heavy_atoms: 15
TPSA: 20.23 NumAromaticRings: 0
AD02368
Formula: C3H9NS

Smiles:
CSCCN
HBA: 1 RingCount: 0
HBD: 2 FractionCSP3: 1.0
AlogP: 0.31 Num_rotatable_bonds: 2
MolWt: 91.18 Num_heavy_atoms: 5
TPSA: 26.02 NumAromaticRings: 0

Sugarmoiety
SD00200

OC1OC(OC2OC(O)C(O)C(O)C2O)C(O)C(O)C1O