GD134343

Name:

2-(hexadecanoyloxy)-3-{[3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}propyl octadec-9-enoate

Formula:

C51H88O14

Smiles:

CCCCCCCCC=CCCCCCCCC(=O)OCC(COC1OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O)OC(=O)CCCCCCCCCCCCCCC

Aglycone:

CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCCCCCC.COC(C)=O

Sugarmoiety:

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

Other Identifiers

• CNP0136643

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

AD05835

Formula: C37H70O5

Smiles:

CCCCCCCCC=CCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCCCCCC

HBA:	5	RingCount:	0
HBD:	1	FractionCSP3:	0.89
AlogP:	10.95	Num_rotatable_bonds:	33
MolWt:	594.96	Num_heavy_atoms:	42
TPSA:	72.83	NumAromaticRings:	0