Glycoside
...
GD138789

Name:
ethyl 4-[2-(methylamino)ethoxy]-1-(5-oxopyrrolidin-3-yl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6H,7H,8H,9H-naphtho[2,1-b]furan-7-carboxylate

Formula:
C28H38O11N2

Smiles:
CCOC(=O)C1CCc2c(c(OC3OC(CO)C(O)C(O)C3O)c(OCCNC)c3occ(C4CN=C(O)C4)c23)C1

Aglycone:
CCOC(=O)C1CCc2c(c(O)c(OCCNC)c3occ(C4CN=C(O)C4)c23)C1

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

Other Identifiers

Properties
HBA: 13 RingCount: 5
HBD: 6 FractionCSP3: 0.64
AlogP: 0.32 Num_rotatable_bonds: 10
MolWt: 578.62 Num_heavy_atoms: 41
TPSA: 192.67 NumAromaticRings: 2

Unique Aglycone
AD55994
Formula: C22H28O6N2

Smiles:
CCOC(=O)C1CCc2c(c(O)c(OCCNC)c3occ(C4CN=C(O)C4)c23)C1
HBA: 8 RingCount: 4
HBD: 3 FractionCSP3: 0.55
AlogP: 2.85 Num_rotatable_bonds: 7
MolWt: 416.47 Num_heavy_atoms: 30
TPSA: 113.52 NumAromaticRings: 2

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O