GD120572

Name:

None

Formula:

C56H97O15N

Smiles:

CCCCCCCCCCCCCCCC=CC(OC(C)=O)C(COC1OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O)N=C(O)C(CCCCCCCCCCCCCCCC)OC(C)=O

Aglycone:

CCCCCCCCCCCCCCCC=CC(OC(C)=O)C(CO)N=C(O)C(CCCCCCCCCCCCCCCC)OC(C)=O.COC(C)=O

Sugarmoiety:

CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

• CNP0428442

AD00017

Formula: C3H6O2

Smiles:

COC(C)=O

HBA:	2	RingCount:	0
HBD:	0	FractionCSP3:	0.67
AlogP:	0.18	Num_rotatable_bonds:	0
MolWt:	74.08	Num_heavy_atoms:	5
TPSA:	26.3	NumAromaticRings:	0

AD48456

Formula: C42H79O6N

Smiles:

CCCCCCCCCCCCCCCC=CC(OC(C)=O)C(CO)N=C(O)C(CCCCCCCCCCCCCCCC)OC(C)=O

HBA:	7	RingCount:	0
HBD:	2	FractionCSP3:	0.88
AlogP:	12.08	Num_rotatable_bonds:	36
MolWt:	694.09	Num_heavy_atoms:	49
TPSA:	105.42	NumAromaticRings:	0