neocarratetraose 4-O-disulfate
Chemical Formula:
C24H36O25S2
Molecular Weight:
788.653 Daltons
Monoisotopic Mass:
790.1143581523 Daltons
SMILES:
C(O)C1(OC(O)C(O)C(C(OS([O-])(=O)=O)1)OC2(OC3(COC(C(O)2)C3OC4(OC(CO)C(OS(=O)([O-])=O)C(C(O)4)OC5(OC6(COC(C(O)5)C6O))))))
InChI:
1S/C24H38O25S2/c25-1-5-15(48-50(33,34)35)19(10(28)21(32)41-5)46-23-12(30)18-14(8(44-23)4-40-18)45-24-13(31)20(16(6(2-26)42-24)49-51(36,37)38)47-22-11(29)17-9(27)7(43-22)3-39-17/h5-32H,1-4H2,(H,33,34,35)(H,36,37,38)/p-2/t5-,6-,7-,8-,9+,10-,11-,12-,13-,14+,15+,16+,17+,18-,19-,20-,21-,22-,23-,24+/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-13446
PubChem (CID):
54758704
Seed:
cpd23881
MetaNetX:
MNXM12443