GD040362

Name:

[(2~{s})-3-[(2~{r},3~{r},4~{r},5~{s},6~{r})-6-(hydroxymethyl)-5-[(2~{r},3~{r},4~{s},5~{s},6~{r})-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3,4-bis(oxidanyl)oxan-2-yl]oxy-2-(12-methyltridecanoyloxy)propyl] 12-methyltridecanoate

Formula:

C43H80O15

Smiles:

CC(C)CCCCCCCCCCC(=O)OC[C@H](CO[C@H]1O[C@H](CO)[C@H](O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)[C@H](O)[C@@H]1O)OC(=O)CCCCCCCCCCC(C)C

Aglycone:

CC(C)CCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCC(C)C

Sugarmoiety:

OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• V7B

AD24737

Formula: C31H60O5

Smiles:

CC(C)CCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCC(C)C

HBA:	5	RingCount:	0
HBD:	1	FractionCSP3:	0.94
AlogP:	8.55	Num_rotatable_bonds:	26
MolWt:	512.82	Num_heavy_atoms:	36
TPSA:	72.83	NumAromaticRings:	0