GD153593

Name:

None

Formula:

C62H90O14N13P

Smiles:

CC1=C2N=C(C=C3N=C(C(C)=C4NC(C(CC(=N)O)C4(C)CCC(O)=NCC(C)OP(=O)(O)OC4C(CO)OC(n5cnc6cc(C)c(C)cc65)C4O)C4(C)N=C1C(CCC(=N)O)C4(C)CC(=N)O)C(CCC(=N)O)C3(C)C)C(CCC(=N)O)C2(C)CC(=N)O

Aglycone:

CC1=C2N=C(C=C3N=C(C(C)=C4NC(C(CC(=N)O)C4(C)CCC(O)=NCC(C)OP(=O)(O)O)C4(C)N=C1C(CCC(=N)O)C4(C)CC(=N)O)C(CCC(=N)O)C3(C)C)C(CCC(=N)O)C2(C)CC(=N)O.Cc1cc2c(cc1C)N=C[N]2

Sugarmoiety:

OCC1OC(O)C(O)C1O

Other Identifiers

• CNP0474232

AD23668

Formula: C9H9N2

Smiles:

Cc1cc2c(cc1C)N=C[N]2

HBA:	2	RingCount:	2
HBD:	0	FractionCSP3:	0.22
AlogP:	2.21	Num_rotatable_bonds:	0
MolWt:	145.19	Num_heavy_atoms:	11
TPSA:	26.46	NumAromaticRings:	1

AD61067

Formula: C48H74O11N11P

Smiles:

CC1=C2N=C(C=C3N=C(C(C)=C4NC(C(CC(=N)O)C4(C)CCC(O)=NCC(C)OP(=O)(O)O)C4(C)N=C1C(CCC(=N)O)C4(C)CC(=N)O)C(CCC(=N)O)C3(C)C)C(CCC(=N)O)C2(C)CC(=N)O

HBA:	22	RingCount:	5
HBD:	16	FractionCSP3:	0.67
AlogP:	8.99	Num_rotatable_bonds:	22
MolWt:	1012.16	Num_heavy_atoms:	71
TPSA:	412.94	NumAromaticRings:	0