Glycoside
...
GD004275

Name:
None

Formula:
C29H40O15N8P2

Smiles:
CCCCCc1ccc(-c2cn(C[C@@H]3O[C@H](OP(=O)(O)OP(=O)(O)OC[C@@H]4O[C@H](n5cnc6c(=O)[nH]c(N)nc65)[C@H](O)[C@H]4O)[C@H](O)[C@H](O)[C@H]3O)nn2)cc1

Aglycone:
CCCCCc1ccc(-c2cn(C)nn2)cc1.COP(=O)(O)OP(=O)(O)O.Nc1nc2c(c(=O)[nH]1)N=C[N]2

Sugarmoiety:
OC1OOC(O)C(O)C1O.OCC1OC(O)C(O)C1O

Other Identifiers

Properties
HBA: 23 RingCount: 6
HBD: 10 FractionCSP3: 0.55
AlogP: -0.93 Num_rotatable_bonds: 15
MolWt: 802.63 Num_heavy_atoms: 54
TPSA: 342.2 NumAromaticRings: 4

Unique Aglycone
AD00207
Formula: C5H4ON5

Smiles:
Nc1nc2c(c(=O)[nH]1)N=C[N]2
HBA: 6 RingCount: 2
HBD: 3 FractionCSP3: 0.0
AlogP: -0.74 Num_rotatable_bonds: 0
MolWt: 150.12 Num_heavy_atoms: 11
TPSA: 98.23 NumAromaticRings: 1
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
AD03756
Formula: C14H19N3

Smiles:
CCCCCc1ccc(-c2cn(C)nn2)cc1
HBA: 3 RingCount: 2
HBD: 0 FractionCSP3: 0.43
AlogP: 3.21 Num_rotatable_bonds: 5
MolWt: 229.33 Num_heavy_atoms: 17
TPSA: 30.71 NumAromaticRings: 2

Sugarmoiety
SD00778

OC1OOC(O)C(O)C1O.OCC1OC(O)C(O)C1O