GD148636

Name:

Alpha-Man-(1->2)-Alpha-Man-(1->2)-Alpha-Man-(1->3)-[Alpha-Man-(1->6)-[Alpha-Man-(1->2)-Alpha-Man-(1->3)]-Alpha-Man-(1->6)]-Beta-Man-(1->4)-Beta-Glcnac-(1->4)-Alpha-Glcnac(Pp-Dol)

Formula:

C89H152O57N2P2

Smiles:

CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)CCOP(=O)(O)OP(=O)(O)OC1OC(CO)C(OC2OC(CO)C(OC3OC(COC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(OC5OC(CO)C(O)C(O)C5OC5OC(CO)C(O)C(O)C5O)C4O)C(O)C(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C3O)C(O)C2N=C(C)O)C(O)C1N=C(C)O

Aglycone:

CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)CCOP(=O)(O)OP(=O)(O)O

Sugarmoiety:

CC(O)=NC1C(O)OC(CO)C(OC2OC(CO)C(OC3OC(COC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(OC5OC(CO)C(O)C(O)C5OC5OC(CO)C(O)C(O)C5O)C4O)C(O)C(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C3O)C(O)C2N=C(C)O)C1O

Other Identifiers

• CNP0142864

AD45143

Formula: C25H46O7P2

Smiles:

CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)CCOP(=O)(O)OP(=O)(O)O

HBA:	7	RingCount:	0
HBD:	3	FractionCSP3:	0.68
AlogP:	8.16	Num_rotatable_bonds:	18
MolWt:	520.58	Num_heavy_atoms:	34
TPSA:	113.29	NumAromaticRings:	0