GD143056

Name:

None

Formula:

C70H112O33

Smiles:

COC1C(O)C(CO)OC(OC2C(O)COC(OC3C(C)OC(OC4C(OC5CCC6(C)C7=CCC89C(=O)OC(C)(C(CCC(C)C)OC(C)=O)C8C(OC(C)=O)CC9(C)C7CCC6C5(C)C)OCC(OC5OC(C)C(O)C(OC6OC(CO)C(O)C(OC)C6O)C5O)C4O)C(O)C3O)C2O)C1O

Aglycone:

CC(=O)OC1CC2(C)C3CCC4C(C)(CCC(O)C4(C)C)C3=CCC23C(=O)OC(C)(C(CCC(C)C)OC(C)=O)C13

Sugarmoiety:

COC1C(O)C(CO)OC(OC2C(O)COC(OC3C(C)OC(OC4C(O)OCC(OC5OC(C)C(O)C(OC6OC(CO)C(O)C(OC)C6O)C5O)C4O)C(O)C3O)C2O)C1O

Other Identifiers

• CNP0433375

AD46764

Formula: C34H52O7

Smiles:

CC(=O)OC1CC2(C)C3CCC4C(C)(CCC(O)C4(C)C)C3=CCC23C(=O)OC(C)(C(CCC(C)C)OC(C)=O)C13

HBA:	7	RingCount:	5
HBD:	1	FractionCSP3:	0.85
AlogP:	6.16	Num_rotatable_bonds:	6
MolWt:	572.78	Num_heavy_atoms:	41
TPSA:	99.13	NumAromaticRings:	0