GD128151

Name:

14'-({3-[(3,5-dihydroxy-6-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl}oxy)-5,7',9',13'-tetramethyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-ene-4,10',16'-triol

Formula:

C51H82O25

Smiles:

CC1COC2(OC3CC4C5CC=C6CC(O)CC(OC7OC(CO)C(O)C(O)C7OC7OC(C)C(O)C(OC8OC(CO)C(O)C(O)C8O)C7O)C6(C)C5CC(O)C4(C)C3C2C)C(OC2OC(C)C(O)C(O)C2O)C1O

Aglycone:

CC1COC2(OC3CC4C5CC=C6CC(O)CC(O)C6(C)C5CC(O)C4(C)C3C2C)C(O)C1O

Sugarmoiety:

CC1OC(O)C(O)C(O)C1O.CC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1O

Other Identifiers

• CNP0315326

AD46629

Formula: C27H42O7

Smiles:

CC1COC2(OC3CC4C5CC=C6CC(O)CC(O)C6(C)C5CC(O)C4(C)C3C2C)C(O)C1O

HBA:	7	RingCount:	6
HBD:	5	FractionCSP3:	0.93
AlogP:	1.6	Num_rotatable_bonds:	0
MolWt:	478.63	Num_heavy_atoms:	34
TPSA:	119.61	NumAromaticRings:	0