GD126472

Name:

24'-hydroxy-12'-({5-[(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-4-methoxy-6-methyloxan-2-yl}oxy)-21'-methoxy-5,11',13',22'-tetramethyl-6-(propan-2-yl)-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-2'-one

Formula:

C48H74O14

Smiles:

COC1CC(OC2C(C)OC(OC3C(C)=CCC4CC(CC5(CCC(C)C(C(C)C)O5)O4)OC(=O)C4C=C(C)C(OC)C5OCC(=CC=CC3C)C45O)CC2OC)OC(C)C1O

Aglycone:

COC1C(C)=CC2C(=O)OC3CC(CC=C(C)C(O)C(C)C=CC=C4COC1C42O)OC1(CCC(C)C(C(C)C)O1)C3

Sugarmoiety:

COC1CC(OC2C(C)OC(O)CC2OC)OC(C)C1O

Other Identifiers

• CNP0161071

AD51175

Formula: C34H50O8

Smiles:

COC1C(C)=CC2C(=O)OC3CC(CC=C(C)C(O)C(C)C=CC=C4COC1C42O)OC1(CCC(C)C(C(C)C)O1)C3

HBA:	8	RingCount:	5
HBD:	2	FractionCSP3:	0.74
AlogP:	4.8	Num_rotatable_bonds:	2
MolWt:	586.77	Num_heavy_atoms:	42
TPSA:	103.68	NumAromaticRings:	0