GD133701

Name:

4,24'-dihydroxy-12'-({5-[(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-4-methoxy-6-methyloxan-2-yl}oxy)-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'-tetraene-2',21'-dione

Formula:

C47H70O15

Smiles:

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

Aglycone:

CC1=CC2C(=O)OC3CC(CC=C(C)C(O)C(C)C=CC=C4COC(C1=O)C42O)OC1(C3)CC(O)C(C)C(C(C)C)O1

Sugarmoiety:

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

Other Identifiers

• CNP0278952

AD54098

Formula: C33H46O9

Smiles:

CC1=CC2C(=O)OC3CC(CC=C(C)C(O)C(C)C=CC=C4COC(C1=O)C42O)OC1(C3)CC(O)C(C)C(C(C)C)O1

HBA:	9	RingCount:	5
HBD:	3	FractionCSP3:	0.7
AlogP:	3.32	Num_rotatable_bonds:	1
MolWt:	586.72	Num_heavy_atoms:	42
TPSA:	131.75	NumAromaticRings:	0