GD036033

Name:

None

Formula:

C54H92O14

Smiles:

CCCCCCCCC=CCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCC1CC1CCCCCCCC)CO[C@@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

CCCCCCCCC=CCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCCC1CC1CCCCCCCC.COC(C)=O

Sugarmoiety:

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

Other Identifiers

• CHEMBL3759352

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

AD16712

Formula: C40H74O5

Smiles:

CCCCCCCCC=CCCCCCCCC(=O)OC(CO)COC(=O)CCCCCCCC1CC1CCCCCCCC

HBA:	5	RingCount:	1
HBD:	1	FractionCSP3:	0.9
AlogP:	11.59	Num_rotatable_bonds:	34
MolWt:	635.03	Num_heavy_atoms:	45
TPSA:	72.83	NumAromaticRings:	0