GD023925

Name:

None

Formula:

C45H73O14N

Smiles:

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

Aglycone:

COC(=O)C(CO)NC(=O)C12CCC(C)(C)CC1C1=CCC3C4(C)CCC(O)C(C)(CO)C4CCC3(C)C1(C)CC2

Sugarmoiety:

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

Other Identifiers

• CHEMBL3427599

AD16041

Formula: C34H55O6N

Smiles:

COC(=O)C(CO)NC(=O)C12CCC(C)(C)CC1C1=CCC3C4(C)CCC(O)C(C)(CO)C4CCC3(C)C1(C)CC2

HBA:	7	RingCount:	5
HBD:	4	FractionCSP3:	0.88
AlogP:	4.77	Num_rotatable_bonds:	5
MolWt:	573.82	Num_heavy_atoms:	41
TPSA:	116.09	NumAromaticRings:	0