Ansamycin: Rifamycin derivative R-112
Molecular Formula:
C38H47N3O11S
InChI: InChI=1/C38H47N3O11S/c1-15-11-10-12-16(2)36(48)40-27-31(46)24-23(26-34(27)53-37(39)41-26)25-33(20(6)30(24)45)52-38(8,35(25)47)50-14-13-22(49-9)17(3)32(51-21(7)42)19(5)29(44)18(4)28(15)43/h10-15,17-19,22,28-29,32,43-46H,1-9H3,(H2,39,41)(H,40,48)/b11-10+,14-13+,16-12+/f/h40H,39H2
InChIKey: InChIKey=ONMWSELJZOYWNK-AZLKWDQZDN
SMILES: CC1C=CC=C(C(=O)NC2=C(C3=C(C4=C(C(=C3O)C)OC(C4=O)(OC=CC(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C5=C2SC(=N5)N)O)C
Names:
Ansamycin: Rifamycin derivative R-112
NSC295119
66892-00-0
Registries:
PubChem CID 5458610
PubChem ID 8140967
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