GD148880

Name:

Sarasinoside L

Formula:

C62H98O28N2

Smiles:

CC(C)=CC(=O)CC(C)C1CC(=O)C2=C3CCC4C(C)(C)C(OC5OCC(OC6OC(CO)C(O)C(O)C6N=C(C)O)C(O)C5OC5OC(COC6OC(CO)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(O)C(O)C5N=C(C)O)CCC4(C)C3(O)CCC21C

Aglycone:

CC(C)=CC(=O)CC(C)C1CC(=O)C2=C3CCC4C(C)(C)C(O)CCC4(C)C3(O)CCC21C

Sugarmoiety:

CC(O)=NC1C(OC2COC(O)C(OC3OC(COC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3N=C(C)O)C2O)OC(CO)C(O)C1O

Other Identifiers

• CNP0160985

AD59554

Formula: C29H44O4

Smiles:

CC(C)=CC(=O)CC(C)C1CC(=O)C2=C3CCC4C(C)(C)C(O)CCC4(C)C3(O)CCC21C

HBA:	4	RingCount:	4
HBD:	2	FractionCSP3:	0.79
AlogP:	5.56	Num_rotatable_bonds:	4
MolWt:	456.67	Num_heavy_atoms:	33
TPSA:	74.6	NumAromaticRings:	0