GD125626

Name:

[3,4,5-tris(acetyloxy)-6-({1,5-dihydroxy-5-methyl-3,8-dioxatricyclo[4.4.0.0²,⁴]dec-9-en-7-yl}oxy)oxan-2-yl]methyl acetate

Formula:

C23H30O14

Smiles:

CC(=O)OCC1OC(OC2OC=CC3(O)C4OC4C(C)(O)C23)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Aglycone:

CC1(O)C2OC2C2(O)C=COC(O)C12.COC(C)=O

Sugarmoiety:

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

Other Identifiers

• CNP0252140

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

AD50809

Formula: C9H12O5

Smiles:

CC1(O)C2OC2C2(O)C=COC(O)C12

HBA:	5	RingCount:	3
HBD:	3	FractionCSP3:	0.78
AlogP:	-1.27	Num_rotatable_bonds:	0
MolWt:	200.19	Num_heavy_atoms:	14
TPSA:	82.45	NumAromaticRings:	0