Concept information
Preferred term
4 fluoro N [[(4S,5R) 2 [(2R) 1 hydroxypropan 2 yl] 8 (2 methoxyphenyl) 4 methyl 1,1 dioxo 4,5 dihydro 3H 6,1$l^/{6/},2 benzoxathiazocin 5 Nethyl benethyl]m
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C28H33FN2O7S2
inchi
- InChI=1S/C28H33FN2O7S2/c1-19-16-31(20(2)18-32)40(35,36)28-14-9-21(24-7-5-6-8-25(24)37-4)15-26(28)38-27(19)17-30(3)39(33,34)23-12-10-22(29)11-13-23/h5-15,19-20,27,32H,16-18H2,1-4H3/t19-,20+,27-/m0/s1
inchikey
- NAXOUWLFRBOFLI-VKIDHGPPSA-N
mass
- 592.702
monoisotopicmass
- 592.17132
smiles
- C[C@H]1CN(S(=O)(=O)C2=C(C=C(C=C2)C3=CC=CC=C3OC)O[C@H]1CN(C)S(=O)(=O)C4=CC=C(C=C4)F)[C@H](C)CO
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:96104
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