GD154135

Name:

methyl 3-ethenyl-4-(2-oxoethyl)-2-{[3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}-3,4-dihydro-2H-pyran-5-carboxylate

Formula:

C25H32O14

Smiles:

C=CC1C(OC2OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)OC=C(C(=O)OC)C1CC=O

Aglycone:

C=CC1C(O)OC=C(C(=O)OC)C1CC=O.COC(C)=O

Sugarmoiety:

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

Other Identifiers

• CNP0219992

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

AD06420

Formula: C11H14O5

Smiles:

C=CC1C(O)OC=C(C(=O)OC)C1CC=O

HBA:	5	RingCount:	1
HBD:	1	FractionCSP3:	0.45
AlogP:	0.4	Num_rotatable_bonds:	4
MolWt:	226.23	Num_heavy_atoms:	16
TPSA:	72.83	NumAromaticRings:	0