GD033991

Name:

None

Formula:

C41H67O13N

Smiles:

C[C@@H]1O[C@H](O[C@@H]2[C@H](O[C@@H]3CC[C@]4(C)[C@H](CC[C@]5(C)[C@H]4CC(=NO)[C@@H]4[C@@H]6CC(C)(C)CC[C@@]6(C(=O)O)CC[C@]45C)[C@@]3(C)CO)OC[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O

Aglycone:

CC1(C)CCC2(C(=O)O)CCC3(C)C(C(=NO)CC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1

Sugarmoiety:

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

Other Identifiers

• CHEMBL4102627

AD21658

Formula: C30H49O5N

Smiles:

CC1(C)CCC2(C(=O)O)CCC3(C)C(C(=NO)CC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1

HBA:	6	RingCount:	5
HBD:	4	FractionCSP3:	0.93
AlogP:	5.73	Num_rotatable_bonds:	2
MolWt:	503.72	Num_heavy_atoms:	36
TPSA:	110.35	NumAromaticRings:	0