Glycoside
...
GD137430

Name:
N-{4-[(6-aminopyridin-3-yl)methyl]-12-hydroxy-8-methoxy-6,11-dioxo-10-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,2,3,4,6,11-hexahydrotetracen-1-yl}-N'-methylguanidine

Formula:
C33H37O10N5

Smiles:
CNC(=N)NC1CCC(Cc2ccc(=N)[nH]c2)c2cc3c(c(O)c21)C(=O)c1c(OC2OC(CO)C(O)C(O)C2O)cc(OC)cc1C3=O

Aglycone:
CNC(=N)NC1CCC(Cc2ccc(=N)[nH]c2)c2cc3c(c(O)c21)C(=O)c1c(O)cc(OC)cc1C3=O

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

Other Identifiers

Properties
HBA: 15 RingCount: 6
HBD: 10 FractionCSP3: 0.39
AlogP: 0.07 Num_rotatable_bonds: 7
MolWt: 663.68 Num_heavy_atoms: 48
TPSA: 250.53 NumAromaticRings: 3

Unique Aglycone
AD51274
Formula: C27H27O5N5

Smiles:
CNC(=N)NC1CCC(Cc2ccc(=N)[nH]c2)c2cc3c(c(O)c21)C(=O)c1c(O)cc(OC)cc1C3=O
HBA: 10 RingCount: 5
HBD: 7 FractionCSP3: 0.26
AlogP: 2.59 Num_rotatable_bonds: 4
MolWt: 501.54 Num_heavy_atoms: 37
TPSA: 171.38 NumAromaticRings: 3

Sugarmoiety
SD00003

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