27-O-demethyl-rifamycin SV
Chemical Formula:
C36H44NO12
Molecular Weight:
682.743 Daltons
Monoisotopic Mass:
683.2941759149 Daltons
SMILES:
CC2(C=CC=C(C)C(=O)NC1(C=C(O)C4(=C(C(O)=1)C([O-])=C(C)C3(OC(OC=CC(O)C(C)C(C(C)C(O)C(C)C(O)2)OC(=O)C)(C)C(=O)C=34))))
InChI:
1S/C36H45NO12/c1-15-10-9-11-16(2)35(46)37-22-14-24(40)25-26(31(22)44)30(43)20(6)33-27(25)34(45)36(8,49-33)47-13-12-23(39)17(3)32(48-21(7)38)19(5)29(42)18(4)28(15)41/h9-15,17-19,23,28-29,32,39-44H,1-8H3,(H,37,46)/p-1/b10-9+,13-12+,16-11-/t15-,17+,18+,19+,23-,28-,29+,32+,36-/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-10237
KEGG:
C14727
Seed:
cpd10425
MetaNetX:
MNXM5493