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About This Item
Empirical Formula (Hill Notation):
C27H27N2NaO9S
CAS Number:
Molecular Weight:
578.57
EC Number:
278-596-9
UNSPSC Code:
12171500
MDL number:
InChI key
VWUJYBNXGHVXSV-OYEQKBROSA-M
InChI
1S/C27H28N2O9S.Na/c1-15-7-17(9-19(26(15)34)11-28-13-23(30)31)25(21-5-3-4-6-22(21)39(36,37)38)18-8-16(2)27(35)20(10-18)12-29-14-24(32)33;/h3-10,28-29,34H,11-14H2,1-2H3,(H,30,31)(H,32,33)(H,36,37,38);/q;+1/p-1/b25-18-;
SMILES string
[Na+].Cc1cc(cc(CNCC(O)=O)c1O)C(=C2/C=C(C)C(=O)C(CNCC(O)=O)=C2)\c3ccccc3S([O-])(=O)=O
technique(s)
titration: suitable
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