Vitas-M small molecule compound

1-hydroxy-9-oxo-9H-xanthen-3-yl N-[(4-methylphenyl)sulfonyl]-D-leucinate

Catalog ID
STK595590
SMILES CC(C[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/c1-15(2)12-20(27-35(31,32)18-10-8-16(3)9-11-18)26(30)33-17-13-21(28)24-23(14-17)34-22-7-5-4-6-19(22)25(24)29/h4-11,13-15,20,27-28H,12H2,1-3H3/t20-/m1/s1
InChIKey
RBLWCUVGSDSBKF-HXUWFJFHSA-N
Synonyms
1014020-98-4
(1hydroxy9oxoxanthen3yl)(2R)4methyl2((4methylphenyl)sulfonylamino)pentanoate
(R)1hydroxy9oxo9Hxanthen3yl4methyl2(4methylphenylsulfonamido)pentanoate
1014020984
1hydroxy9oxo9Hxanthen3ylN((4methylphenyl)sulfonyl)Dleucinate
CC(C(C@H)(C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1)NS(=O)(=O)c1ccc(cc1)C)C
CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)OC2=CC(=C3C(=C2)OC4=CC=CC=C4C3=O)O
InChI=1SC26H25NO7Sc115(2)1220(2735(3132)1810816(3)91118)26(30)33171321(28)2423(1417)3422754619(22)25(24)29h4111315202728H12H213H3t20m1s1
MFCD08284491
ZINC000013591270
ZINC13591270

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Available files

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