proansamycin X
Chemical Formula:
C35H46NO10
Molecular Weight:
640.749 Daltons
Monoisotopic Mass:
641.3199967349 Daltons
SMILES:
CC1(C(O)C(C)C(C(C(C(C)C(O)C(C)C=C(C)C(=O)C3(C2(C(=O)C=C(NC(=O)C(=CC=C1)C)C(=O)C=2C(O)C(C)C([O-])=3)))O)C)O)
InChI:
1S/C35H47NO10/c1-14-10-9-11-15(2)35(46)36-22-13-23(37)24-25(32(43)21(8)33(44)26(24)34(22)45)29(40)17(4)12-16(3)28(39)19(6)31(42)20(7)30(41)18(5)27(14)38/h9-14,16,18-21,27-28,30-31,33,38-39,41-44H,1-8H3,(H,36,46)/p-1/b10-9+,15-11-,17-12+
InChIKey:
Databases
MetaCyc:
CPD-10241
MetaboLights:
MTBLC71970
LIPID MAPS:
LMPK05000006
ChEBI:
71970
KEGG:
C12176
Seed:
cpd08956
MetaNetX:
MNXM78081