Glycoside
...
GD145624

Name:
5-hydroxy-4-(hydroxymethyl)-1-{2-[3-(3-hydroxypropyl)phenyl]ethenyl}-9,10-dioxo-6-(piperidin-4-yl)-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-9,10-dihydroanthracen-2-yl acetate

Formula:
C39H43O12N

Smiles:
CC(=O)Oc1cc(CO)c2c(c1C=Cc1cccc(CCCO)c1)C(=O)c1cc(OC3OC(C)C(O)C(O)C3O)c(C3CCNCC3)c(O)c1C2=O

Aglycone:
CC(=O)Oc1cc(CO)c2c(c1C=Cc1cccc(CCCO)c1)C(=O)c1cc(O)c(C3CCNCC3)c(O)c1C2=O

Sugarmoiety:
CC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 6
HBD: 7 FractionCSP3: 0.41
AlogP: 2.35 Num_rotatable_bonds: 10
MolWt: 717.77 Num_heavy_atoms: 52
TPSA: 212.31 NumAromaticRings: 3

Unique Aglycone
AD58437
Formula: C33H33O8N

Smiles:
CC(=O)Oc1cc(CO)c2c(c1C=Cc1cccc(CCCO)c1)C(=O)c1cc(O)c(C3CCNCC3)c(O)c1C2=O
HBA: 9 RingCount: 5
HBD: 5 FractionCSP3: 0.3
AlogP: 3.85 Num_rotatable_bonds: 8
MolWt: 571.63 Num_heavy_atoms: 42
TPSA: 153.39 NumAromaticRings: 3

Sugarmoiety
SD00076

CC1OC(O)C(O)C(O)C1O