GD142275

Name:

2-({2-[(2-{[4,5-dihydroxy-2-(hydroxymethyl)-6-{5',7,9,13-tetramethyl-5-oxaspiro[pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane-6,2'-piperidine]oxy}oxan-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl)oxy]-4,5-dihydroxyoxan-3-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triol

Formula:

C50H83O21N

Smiles:

CC1CCC2(NC1)OC1CC3C4CCC5CC(OC6OC(CO)C(OC7OC(CO)C(O)C(OC8OCC(O)C(O)C8OC8OC(CO)C(O)C(O)C8O)C7O)C(O)C6O)CCC5(C)C4CCC3(C)C1C2C

Aglycone:

CC1CCC2(NC1)OC1CC3C4CCC5CC(O)CCC5(C)C4CCC3(C)C1C2C

Sugarmoiety:

OCC1OC(OC2C(OC3C(O)C(CO)OC(OC4C(CO)OC(O)C(O)C4O)C3O)OCC(O)C2O)C(O)C(O)C1O

Other Identifiers

• CNP0277007

AD08743

Formula: C27H45O2N

Smiles:

CC1CCC2(NC1)OC1CC3C4CCC5CC(O)CCC5(C)C4CCC3(C)C1C2C

HBA:	3	RingCount:	6
HBD:	2	FractionCSP3:	1.0
AlogP:	5.37	Num_rotatable_bonds:	0
MolWt:	415.66	Num_heavy_atoms:	30
TPSA:	41.49	NumAromaticRings:	0