Glycoside
...
GD037969

Name:
3'-deoxy-3'-{[(2e)-3-(4-{[(4z)-6-o-(6-deoxy-3,4-di-o-methyl-alpha-d-mannopyranosyl)-5-o-methyl-alpha-d-threo-hex-4-enofuranosyl]oxy}phenyl)-2-methylprop-2-enoyl]amino}-n,n-dimethyladenosine

Formula:
C37H50O14N6

Smiles:
COC(CO[C@H]1O[C@H](C)[C@@H](OC)[C@@H](OC)[C@H]1O)=C1O[C@H](Oc2ccc(C=C(C)C(=O)N[C@@H]3[C@@H](CO)O[C@@H](n4cnc5c(N(C)C)ncnc54)[C@H]3O)cc2)[C@H](O)[C@@H]1O

Aglycone:
COC(CO)=C1OC(Oc2ccc(C=C(C)C(=O)NC3C(CO)OC(n4cnc5c(N(C)C)ncnc54)C3O)cc2)C(O)C1O

Sugarmoiety:
COC1C(C)OC(O)C(O)C1OC

Other Identifiers

Properties
HBA: 20 RingCount: 6
HBD: 6 FractionCSP3: 0.57
AlogP: -0.8 Num_rotatable_bonds: 14
MolWt: 802.84 Num_heavy_atoms: 57
TPSA: 250.93 NumAromaticRings: 3

Unique Aglycone
AD14912
Formula: C29H36O10N6

Smiles:
COC(CO)=C1OC(Oc2ccc(C=C(C)C(=O)NC3C(CO)OC(n4cnc5c(N(C)C)ncnc54)C3O)cc2)C(O)C1O
HBA: 16 RingCount: 5
HBD: 6 FractionCSP3: 0.45
AlogP: -0.96 Num_rotatable_bonds: 10
MolWt: 628.64 Num_heavy_atoms: 45
TPSA: 214.01 NumAromaticRings: 3

Sugarmoiety
SD02433

COC1C(C)OC(O)C(O)C1OC