GD140954

Name:

None

Formula:

C84H135O40N

Smiles:

CC(=O)OCC1OC(OC(CC(C)C)C(CCCCCCCCCC(=O)CCCCCCCCCCCCCCC(=O)N(C)C(C)C(=O)O)OC(C)=O)C(O)C(O)C1OC1OCC(O)C(OC2OC(CO)C(O)C(OC3OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C3OC(C)=O)C2O)C1OC1OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Aglycone:

CC(=O)OC(CCCCCCCCCC(=O)CCCCCCCCCCCCCCC(=O)N(C)C(C)C(=O)O)C(O)CC(C)C.COC(C)=O.COC(C)=O.COC(C)=O

Sugarmoiety:

CC(=O)OCC1OC(OC2C(OC3C(O)OC(O)C(O)C3O)OCC(O)C2OC2OC(CO)C(O)C(OC3OC(O)OC(OC(C)=O)C3OC(C)=O)C2O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

• CNP0432893

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

AD56824

Formula: C37H69O7N

Smiles:

CC(=O)OC(CCCCCCCCCC(=O)CCCCCCCCCCCCCCC(=O)N(C)C(C)C(=O)O)C(O)CC(C)C

HBA:	8	RingCount:	0
HBD:	2	FractionCSP3:	0.89
AlogP:	8.8	Num_rotatable_bonds:	31
MolWt:	639.96	Num_heavy_atoms:	45
TPSA:	121.21	NumAromaticRings:	0