Vitas-M small molecule compound
4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl N-[(4-methylphenyl)sulfonyl]-L-isoleucinate
Catalog ID
STL462708
SMILES CC[C@H]([C@@H](C(=O)Oc1ccc2c(c1C)oc(=O)c1c2CCCC1)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 C27H31NO6S MW 497.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31NO6S/c1-5-17(3)24(28-35(31,32)19-12-10-16(2)11-13-19)27(30)33-23-15-14-21-20-8-6-7-9-22(20)26(29)34-25(21)18(23)4/h10-15,17,24,28H,5-9H2,1-4H3/t17-,24+/m1/s1InChIKey
FTVOPBJHRUNGHM-OSPHWJPCSA-NSynonyms
1173688-33-9(2S3R)4methyl6oxo78910tetrahydro6Hbenzo(c)chromen3yl3methyl2(4methylphenylsulfonamido)pentanoate
(4methyl6oxo78910tetrahydrobenzo(c)chromen3yl)(2S3R)3methyl2((4methylphenyl)sulfonylamino)pentanoate
1173688339
4methyl6oxo78910tetrahydro6Hbenzo(c)chromen3ylN((4methylphenyl)sulfonyl)Lisoleucinate
CCC(C)C(C(=O)OC1=C(C2=C(C=C1)C3=C(CCCC3)C(=O)O2)C)NS(=O)(=O)C4=CC=C(C=C4)C
InChI=1SC27H31NO6Sc1517(3)24(2835(3132)19121016(2)111319)27(30)332315142120867922(20)26(29)3425(21)18(23)4h1015172428H59H214H3t1724+m1s1
MFCD10041202
ZINC000002094731
ZINC02094731
ZINC2094731
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