Glycoside
...
GD028494

Name:
None

Formula:
C49H58O18N10

Smiles:
COc1ccc2c(c1)Oc1cc(O)ccc1C2=C1C=CC(=Nc2nc(O)nc(NCCCC[C@H](NC(=O)CC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)OC3C(O)C(CO)OC(O)C3NC(C)=O)C(N)=O)C(=O)O)n2)C=C1C(=O)O

Aglycone:
COc1ccc2c(c1)Oc1cc(O)ccc1C2=C1C=CC(=Nc2nc(O)nc(NCCCCC(NC(=O)CCC(NC(=O)C(C)NC(=O)C(C)O)C(N)=O)C(=O)O)n2)C=C1C(=O)O

Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 28 RingCount: 6
HBD: 14 FractionCSP3: 0.41
AlogP: -0.69 Num_rotatable_bonds: 23
MolWt: 1075.06 Num_heavy_atoms: 77
TPSA: 435.22 NumAromaticRings: 3

Unique Aglycone
AD18606
Formula: C41H45O13N9

Smiles:
COc1ccc2c(c1)Oc1cc(O)ccc1C2=C1C=CC(=Nc2nc(O)nc(NCCCCC(NC(=O)CCC(NC(=O)C(C)NC(=O)C(C)O)C(N)=O)C(=O)O)n2)C=C1C(=O)O
HBA: 22 RingCount: 5
HBD: 11 FractionCSP3: 0.32
AlogP: 1.34 Num_rotatable_bonds: 19
MolWt: 871.86 Num_heavy_atoms: 63
TPSA: 347.2 NumAromaticRings: 3

Sugarmoiety
SD00014

CC(=O)NC1C(O)OC(CO)C(O)C1O