GD002283

Name:

None

Formula:

C46H73O14N

Smiles:

C[C@H](NC[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@H](O)[C@H](C)[C@H]6O)C(C)(C)[C@H]5CC[C@]43C)[C@H]2C1)C(=O)O

Aglycone:

CC(NCC1(C)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1)C(=O)O

Sugarmoiety:

CC1C(O)C(CO)OC(OC2C(O)OC(C(=O)O)C(O)C2O)C1O

Other Identifiers

• CHEMBL2314417

AD02195

Formula: C33H53O4N

Smiles:

CC(NCC1(C)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1)C(=O)O

HBA:	5	RingCount:	5
HBD:	3	FractionCSP3:	0.88
AlogP:	6.39	Num_rotatable_bonds:	4
MolWt:	527.79	Num_heavy_atoms:	38
TPSA:	86.63	NumAromaticRings:	0