Vitas-M small molecule compound
1-hydroxy-9-oxo-9H-xanthen-3-yl N-[(4-methylphenyl)sulfonyl]-D-isoleucinate
Catalog ID
STK571870
SMILES CC[C@@H]([C@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1)NS(=O)(=O)c1ccc(cc1)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C26H25NO7S MW 495.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25NO7S/c1-4-16(3)24(27-35(31,32)18-11-9-15(2)10-12-18)26(30)33-17-13-20(28)23-22(14-17)34-21-8-6-5-7-19(21)25(23)29/h5-14,16,24,27-28H,4H2,1-3H3/t16-,24+/m0/s1InChIKey
ANYNYGYOLBTJJK-UPCLLVRISA-NSynonyms
1014085-31-4(1hydroxy9oxoxanthen3yl)(2R3S)3methyl2((4methylphenyl)sulfonylamino)pentanoate
(2R3S)1hydroxy9oxo9Hxanthen3yl3methyl2(4methylphenylsulfonamido)pentanoate
1014085314
1hydroxy9oxo9Hxanthen3ylN((4methylphenyl)sulfonyl)Disoleucinate
CC(C@@H)((C@H)(C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1)NS(=O)(=O)c1ccc(cc1)C)C
CCC(C)C(C(=O)OC1=CC(=C2C(=C1)OC3=CC=CC=C3C2=O)O)NS(=O)(=O)C4=CC=C(C=C4)C
InChI=1SC26H25NO7Sc1416(3)24(2735(3132)1811915(2)101218)26(30)33171320(28)2322(1417)3421865719(21)25(23)29h51416242728H4H213H3t1624+m0s1
MFCD18245430
ZINC000013576962
ZINC13576962
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