GD000751

Name:

SPIRAMYCIN

Formula:

C43H74O14N2

Smiles:

CO[C@H]1[C@H](O)CC(=O)O[C@@H](C)CC=CC=C[C@@H](O[C@@H]2CC[C@H](N(C)C)[C@H](C)O2)[C@@H](C)C[C@@H](CC=O)[C@H]1O[C@@H]1O[C@H](C)[C@H](O[C@@H]2C[C@@](C)(O)[C@H](O)[C@H](C)O2)[C@H](N(C)C)[C@H]1O

Aglycone:

COC1C(O)CC(=O)OC(C)CC=CC=CC(OC2CCC(N(C)C)C(C)O2)C(C)CC(CC=O)C1O

Sugarmoiety:

CC1OC(O)C(O)C(N(C)C)C1OC1CC(C)(O)C(O)C(C)O1

Other Identifiers

• CHEMBL1255799
• CHEMBL453514
• DB06145
• CNP0408996

AD00798

Formula: C28H47O8N

Smiles:

COC1C(O)CC(=O)OC(C)CC=CC=CC(OC2CCC(N(C)C)C(C)O2)C(C)CC(CC=O)C1O

HBA:	9	RingCount:	2
HBD:	2	FractionCSP3:	0.79
AlogP:	2.63	Num_rotatable_bonds:	6
MolWt:	525.68	Num_heavy_atoms:	37
TPSA:	114.76	NumAromaticRings:	0