GD108402

Name:

None

Formula:

C23H34O12

Smiles:

CC(=O)OC[C@@H](OC(C)=O)[C@H]1O[C@@H](OC2CCCCC2)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

CC(=O)OCCOC(C)=O.OC1CCCCC1

Sugarmoiety:

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

Other Identifiers

• ZINC000005339414

AD05458

Formula: C6H10O4

Smiles:

CC(=O)OCCOC(C)=O

HBA:	4	RingCount:	0
HBD:	0	FractionCSP3:	0.67
AlogP:	0.11	Num_rotatable_bonds:	3
MolWt:	146.14	Num_heavy_atoms:	10
TPSA:	52.6	NumAromaticRings:	0

AD06056

Formula: C6H12O

Smiles:

OC1CCCCC1

HBA:	1	RingCount:	1
HBD:	1	FractionCSP3:	1.0
AlogP:	1.31	Num_rotatable_bonds:	0
MolWt:	100.16	Num_heavy_atoms:	7
TPSA:	20.23	NumAromaticRings:	0