hydroxychlorobactene glucoside
Chemical Formula:
C46H64O6
Molecular Weight:
713.008 Daltons
Monoisotopic Mass:
712.470289787 Daltons
SMILES:
CC(=CC=CC=C(C=CC=C(C=CC1(C(C)=C(C)C=CC=1C))C)C)C=CC=C(C=CC=C(CCCC(OC2(OC(CO)C(O)C(O)C(O)2))(C)C)C)C
InChI:
1S/C46H64O6/c1-32(17-11-12-18-33(2)20-15-24-36(5)26-29-40-38(7)28-27-37(6)39(40)8)19-13-21-34(3)22-14-23-35(4)25-16-30-46(9,10)52-45-44(50)43(49)42(48)41(31-47)51-45/h11-15,17-24,26-29,41-45,47-50H,16,25,30-31H2,1-10H3/b12-11+,19-13+,20-15+,22-14+,29-26+,32-17+,33-18+,34-21+,35-23+,36-24+/t41-,42-,43+,44-,45+/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-20628
ChEBI:
80172
KEGG:
C15914
PubChem (CID):
23724603