GD021387

Name:

CHROMOMYCIN SA3

Formula:

C52H74O24

Smiles:

CO[C@H](C(=O)O)[C@@H]1Cc2cc3cc(O[C@H]4C[C@@H](O[C@H]5C[C@@H](O)[C@@H](OC)[C@H](C)O5)[C@H](OC(C)=O)[C@@H](C)O4)c(C)c(O)c3c(O)c2C(=O)[C@@H]1O[C@@H]1C[C@H](O[C@@H]2C[C@H](O[C@@H]3C[C@@](C)(O)[C@H](O)[C@H](C)O3)[C@H](O)[C@H](C)O2)[C@H](O)[C@H](C)O1

Aglycone:

COC(C(=O)O)C1Cc2cc3cc(O)c(C)c(O)c3c(O)c2C(=O)C1O

Sugarmoiety:

CC1OC(O)CC(OC2CC(OC3CC(C)(O)C(O)C(C)O3)C(O)C(C)O2)C1O.COC1C(O)CC(OC2CC(O)OC(C)C2OC(C)=O)OC1C

Other Identifiers

• CHEMBL1817809
• CNP0115413

AD03879

Formula: C18H18O8

Smiles:

COC(C(=O)O)C1Cc2cc3cc(O)c(C)c(O)c3c(O)c2C(=O)C1O

HBA:	8	RingCount:	3
HBD:	5	FractionCSP3:	0.33
AlogP:	1.08	Num_rotatable_bonds:	3
MolWt:	362.33	Num_heavy_atoms:	26
TPSA:	144.52	NumAromaticRings:	2