2-demethylmenaquinone-11
Chemical Formula:
C65H94O2
Molecular Weight:
907.456 Daltons
Monoisotopic Mass:
906.7253822616 Daltons
SMILES:
CC(=CCCC(=CCCC(=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCC1(=CC(=O)C2(C=CC=CC(C(=O)1)=2)))C)C)C
InChI:
1S/C65H94O2/c1-50(2)25-15-26-51(3)27-16-28-52(4)29-17-30-53(5)31-18-32-54(6)33-19-34-55(7)35-20-36-56(8)37-21-38-57(9)39-22-40-58(10)41-23-42-59(11)43-24-44-60(12)47-48-61-49-64(66)62-45-13-14-46-63(62)65(61)67/h13-14,25,27,29,31,33,35,37,39,41,43,45-47,49H,15-24,26,28,30,32,34,36,38,40,42,44,48H2,1-12H3/b51-27+,52-29+,53-31+,54-33+,55-35+,56-37+,57-39+,58-41+,59-43+,60-47+
InChIKey:
Databases
MetaCyc:
CPD-9969
PubChem (CID):
25244579
Seed:
cpd25918
MetaNetX:
MNXM17200