GD118753

Name:

[3,4,5-tris(acetyloxy)-6-[(8-hydroxy-1,4-dioxo-3-{[3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}-1,4-dihydronaphthalen-2-yl)oxy]oxan-2-yl]methyl acetate

Formula:

C38H42O23

Smiles:

CC(=O)OCC1OC(OC2=C(OC3OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C3OC(C)=O)C(=O)c3c(O)cccc3C2=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Aglycone:

COC(C)=O.COC(C)=O.O=C1C(O)=C(O)C(=O)c2c(O)cccc21

Sugarmoiety:

CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O.CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

• CNP0360978

AD00017

Formula: C3H6O2

Smiles:

COC(C)=O

HBA:	2	RingCount:	0
HBD:	0	FractionCSP3:	0.67
AlogP:	0.18	Num_rotatable_bonds:	0
MolWt:	74.08	Num_heavy_atoms:	5
TPSA:	26.3	NumAromaticRings:	0

AD47510

Formula: C10H6O5

Smiles:

O=C1C(O)=C(O)C(=O)c2c(O)cccc21

HBA:	5	RingCount:	2
HBD:	3	FractionCSP3:	0.0
AlogP:	1.1	Num_rotatable_bonds:	0
MolWt:	206.15	Num_heavy_atoms:	15
TPSA:	94.83	NumAromaticRings:	1