Glycoside
...
GD124180

Name:
None

Formula:
C36H46O13N2

Smiles:
CC(C)CC(N=C(O)C(N=C(O)C1OC(Oc2cc3oc(-c4ccccc4)cc(=O)c3c(O)c2O)C(O)C(O)C1O)C(C)C)C(=O)OC(C)(C)C

Aglycone:
CC(C)CC(N=C(O)C(N=CO)C(C)C)C(=O)OC(C)(C)C.O=c1cc(-c2ccccc2)oc2cc(O)c(O)c(O)c12

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

Other Identifiers

Properties
HBA: 15 RingCount: 4
HBD: 7 FractionCSP3: 0.5
AlogP: 3.75 Num_rotatable_bonds: 11
MolWt: 714.77 Num_heavy_atoms: 51
TPSA: 241.3 NumAromaticRings: 3

Unique Aglycone
AD02851
Formula: C15H10O5

Smiles:
O=c1cc(-c2ccccc2)oc2cc(O)c(O)c(O)c12
HBA: 5 RingCount: 3
HBD: 3 FractionCSP3: 0.0
AlogP: 2.58 Num_rotatable_bonds: 1
MolWt: 270.24 Num_heavy_atoms: 20
TPSA: 90.9 NumAromaticRings: 3
AD50147
Formula: C16H30O4N2

Smiles:
CC(C)CC(N=C(O)C(N=CO)C(C)C)C(=O)OC(C)(C)C
HBA: 6 RingCount: 0
HBD: 2 FractionCSP3: 0.81
AlogP: 3.31 Num_rotatable_bonds: 7
MolWt: 314.43 Num_heavy_atoms: 22
TPSA: 91.48 NumAromaticRings: 0

Sugarmoiety
SD00017

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