GD018410

Name:

STREPTONICOZID

Formula:

C27H44O12N10

Smiles:

CN[C@@H]1[C@H](O[C@@H]2[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@@H](NC(=N)N)[C@@H](O)[C@H]3NC(=N)N)O[C@H](C)[C@@]2(O)C=NNC(=O)c2ccncc2)O[C@H](CO)[C@H](O)[C@H]1O

Aglycone:

C=NNC(=O)c1ccncc1.N=C(N)NC1C(O)C(O)C(O)C(NC(=N)N)C1O

Sugarmoiety:

CNC1C(OC2C(O)OC(C)C2(O)O)OC(CO)C(O)C1O

Other Identifiers

• CHEMBL2103899
• CHEMBL2110590
• CNP0330906

AD02685

Formula: C7H7ON3

Smiles:

C=NNC(=O)c1ccncc1

HBA:	4	RingCount:	1
HBD:	1	FractionCSP3:	0.0
AlogP:	0.43	Num_rotatable_bonds:	2
MolWt:	149.15	Num_heavy_atoms:	11
TPSA:	54.35	NumAromaticRings:	1

AD07399

Formula: C8H18O4N6

Smiles:

N=C(N)NC1C(O)C(O)C(O)C(NC(=N)N)C1O

HBA:	10	RingCount:	1
HBD:	12	FractionCSP3:	0.75
AlogP:	-4.85	Num_rotatable_bonds:	2
MolWt:	262.27	Num_heavy_atoms:	18
TPSA:	204.72	NumAromaticRings:	0