Vitas-M small molecule compound
1-hydroxy-5-methyl-9-oxo-9H-xanthen-3-yl N-[(4-methylphenyl)sulfonyl]-D-phenylalaninate
Catalog ID
STK584138
SMILES O=C([C@H](NS(=O)(=O)c1ccc(cc1)C)Cc1ccccc1)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C
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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 C30H25NO7S MW 543.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25NO7S/c1-18-11-13-22(14-12-18)39(35,36)31-24(15-20-8-4-3-5-9-20)30(34)37-21-16-25(32)27-26(17-21)38-29-19(2)7-6-10-23(29)28(27)33/h3-14,16-17,24,31-32H,15H2,1-2H3/t24-/m1/s1InChIKey
QHMGDZDQVZXIAY-XMMPIXPASA-NSynonyms
1014063-95-6(1hydroxy5methyl9oxoxanthen3yl)(2R)2((4methylphenyl)sulfonylamino)3phenylpropanoate
(R)1hydroxy5methyl9oxo9Hxanthen3yl2(4methylphenylsulfonamido)3phenylpropanoate
1014063956
1hydroxy5methyl9oxo9Hxanthen3ylN((4methylphenyl)sulfonyl)Dphenylalaninate
CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)OC3=CC(=C4C(=C3)OC5=C(C4=O)C=CC=C5C)O
InChI=1SC30H25NO7Sc118111322(141218)39(3536)3124(15208435920)30(34)37211625(32)2726(1721)382919(2)761023(29)28(27)33h3141617243132H15H212H3t24m1s1
MFCD08284508
O=C((C@H)(NS(=O)(=O)c1ccc(cc1)C)Cc1ccccc1)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C
ZINC000101381128
ZINC101381128
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