Glycoside

GD037028
Name:
NoneFormula:
C29H31O8N6PSmiles:
CCOC(=O)[C@H](Cc1ccccc1)NP(=O)(OC[C@@H]1O[C@](C#N)(c2ccc3c(N)ncnn23)[C@H](O)[C@H]1O)Oc1ccccc1Aglycone:
CCOC(=O)C(Cc1ccccc1)NP(=O)(OC)Oc1ccccc1.Nc1ncnn2cccc12Sugarmoiety:
N#CC1(O)OC(O)C(O)C1OOther Identifiers
Properties
HBA: | 14 | RingCount: | 5 |
HBD: | 5 | FractionCSP3: | 0.31 |
AlogP: | 2.12 | Num_rotatable_bonds: | 12 |
MolWt: | 622.58 | Num_heavy_atoms: | 44 |
TPSA: | 203.55 | NumAromaticRings: | 4 |
Unique Aglycone
AD05072
Formula: C6H6N4
Smiles:
Nc1ncnn2cccc12HBA: | 4 | RingCount: | 2 |
HBD: | 2 | FractionCSP3: | 0.0 |
AlogP: | 0.31 | Num_rotatable_bonds: | 0 |
MolWt: | 134.14 | Num_heavy_atoms: | 10 |
TPSA: | 56.21 | NumAromaticRings: | 2 |
AD07714
Formula: C18H22O5NP
Smiles:
CCOC(=O)C(Cc1ccccc1)NP(=O)(OC)Oc1ccccc1HBA: | 6 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.28 |
AlogP: | 3.58 | Num_rotatable_bonds: | 9 |
MolWt: | 363.35 | Num_heavy_atoms: | 25 |
TPSA: | 73.86 | NumAromaticRings: | 2 |