GD025034

Name:

None

Formula:

C52H77O17N

Smiles:

COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@]12CC[C@@](C)(C(=O)OC)C[C@H]1C1=CC[C@@H]3[C@]4(C)C[C@H](O)[C@H](O[C@@H]5OC[C@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@](C)(CO)[C@H]4CC[C@@]3(C)[C@@]1(C)CC2

Aglycone:

COC(=O)C(Cc1ccccc1)NC(=O)C12CCC(C)(C(=O)OC)CC1C1=CCC3C4(C)CC(O)C(O)C(C)(CO)C4CCC3(C)C1(C)CC2

Sugarmoiety:

OCC1OC(OC2COC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CHEMBL410789

AD16644

Formula: C41H59O8N

Smiles:

COC(=O)C(Cc1ccccc1)NC(=O)C12CCC(C)(C(=O)OC)CC1C1=CCC3C4(C)CC(O)C(O)C(C)(CO)C4CCC3(C)C1(C)CC2

HBA:	9	RingCount:	6
HBD:	4	FractionCSP3:	0.73
AlogP:	5.15	Num_rotatable_bonds:	7
MolWt:	693.92	Num_heavy_atoms:	50
TPSA:	142.39	NumAromaticRings:	1