GD118589

Name:

2-[(2-{5-[6-({4,5-dihydroxy-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl}oxy)-7,7,12,16-tetramethyl-14-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-9-[(3,4,5-trihydroxyoxan-2-yl)oxy]pentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-15-yl]-5-methyloxolan-2-yl}propan-2-yl)oxy]-6-methyloxane-3,4,5-triol

Formula:

C57H94O25

Smiles:

CC1OC(OC2CC3(C)C4CC(OC5OCC(O)C(O)C5O)C5C(C)(C)C(OC6OCC(O)C(O)C6OC6OCC(O)C(O)C6O)CCC56CC46CCC3(C)C2C2(C)CCC(C(C)(C)OC3OC(C)C(O)C(O)C3O)O2)C(O)C(O)C1O

Aglycone:

CC(C)(O)C1CCC(C)(C2C(O)CC3(C)C4CC(O)C5C(C)(C)C(O)CCC56CC46CCC23C)O1

Sugarmoiety:

CC1OC(O)C(O)C(O)C1O.CC1OC(O)C(O)C(O)C1O.OC1COC(O)C(O)C1O.OC1COC(OC2C(O)OCC(O)C2O)C(O)C1O

Other Identifiers

• CNP0345964

AD04921

Formula: C30H50O5

Smiles:

CC(C)(O)C1CCC(C)(C2C(O)CC3(C)C4CC(O)C5C(C)(C)C(O)CCC56CC46CCC23C)O1

HBA:	5	RingCount:	6
HBD:	4	FractionCSP3:	1.0
AlogP:	4.44	Num_rotatable_bonds:	2
MolWt:	490.73	Num_heavy_atoms:	35
TPSA:	90.15	NumAromaticRings:	0