Glycoside
...
GD029509

Name:
None

Formula:
C30H48O24N10P4S4

Smiles:
Nc1ncnc2c1nc(SCCS(=O)(=O)CCCCCCS(=O)(=O)CCSc1nc3c(N)ncnc3n1C1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@H](O)[C@H]1O)n2C1O[C@H](COP(=O)(O)OP(=O)(O)O)[C@H](O)[C@H]1O

Aglycone:
COP(=O)(O)OP(=O)(O)O.COP(=O)(O)OP(=O)(O)O.Nc1ncnc2c1N=C(SCCS(=O)(=O)CCCCCCS(=O)(=O)CCSC1=Nc3c(N)ncnc3[N]1)[N]2

Sugarmoiety:
OC1OC(O)C(O)C1O.OC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 34 RingCount: 6
HBD: 14 FractionCSP3: 0.67
AlogP: -1.9 Num_rotatable_bonds: 27
MolWt: 1184.92 Num_heavy_atoms: 72
TPSA: 533.48 NumAromaticRings: 4

Unique Aglycone
AD00305
Formula: CH6O7P2

Smiles:
COP(=O)(O)OP(=O)(O)O
HBA: 7 RingCount: 0
HBD: 3 FractionCSP3: 1.0
AlogP: -0.16 Num_rotatable_bonds: 3
MolWt: 192.0 Num_heavy_atoms: 10
TPSA: 113.29 NumAromaticRings: 0
AD19190
Formula: C20H26O4N10S4

Smiles:
Nc1ncnc2c1N=C(SCCS(=O)(=O)CCCCCCS(=O)(=O)CCSC1=Nc3c(N)ncnc3[N]1)[N]2
HBA: 14 RingCount: 4
HBD: 4 FractionCSP3: 0.5
AlogP: 1.46 Num_rotatable_bonds: 13
MolWt: 598.76 Num_heavy_atoms: 38
TPSA: 224.8 NumAromaticRings: 2

Sugarmoiety
SD00025

OC1OC(O)C(O)C1O.OC1OC(O)C(O)C1O