GD153773

Name:

12-{[4-({4-[(3,5-dihydroxy-6-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl}oxy)-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-hydroxypentadecanoic acid

Formula:

C39H70O23

Smiles:

CCCC(CCCCCCCCC(O)CC(=O)O)OC1OC(CO)C(O)C(OC2OC(CO)C(O)C(OC3OC(C)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3O)C2O)C1O

Aglycone:

CCCC(O)CCCCCCCCC(O)CC(=O)O

Sugarmoiety:

CC1OC(OC2C(O)C(CO)OC(OC3C(O)C(O)OC(CO)C3O)C2O)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1O

Other Identifiers

• CNP0238488

AD61129

Formula: C15H30O4

Smiles:

CCCC(O)CCCCCCCCC(O)CC(=O)O

HBA:	4	RingCount:	0
HBD:	3	FractionCSP3:	0.93
AlogP:	3.1	Num_rotatable_bonds:	13
MolWt:	274.4	Num_heavy_atoms:	19
TPSA:	77.76	NumAromaticRings:	0