Vitas-M small molecule compound
(2S)-{[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]amino}(phenyl)ethanoic acid
Catalog ID
STL464019
SMILES O=C(N[C@@H](c1ccccc1)C(=O)O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2
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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 C28H27NO6 MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27NO6/c1-15-18(12-13-23(30)29-24(27(31)32)17-8-4-3-5-9-17)28(33)35-25-16(2)26-21(14-20(15)25)19-10-6-7-11-22(19)34-26/h3-5,8-9,14,24H,6-7,10-13H2,1-2H3,(H,29,30)(H,31,32)/t24-/m0/s1InChIKey
AGLLJUZJKSKSNW-DEOSSOPVSA-NSynonyms
(2S)((3(411dimethyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)propanoyl)amino)(phenyl)ethanoicacid
(2S)2(3(411dimethyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)propanoylamino)2phenylaceticacid
2(3(411dimethyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)propanamido)2phenylaceticacid
CC1=C(C(=O)OC2=C1C=C3C4=C(CCCC4)OC3=C2C)CCC(=O)NC(C5=CC=CC=C5)C(=O)O
InChI=1SC28H27NO6c11518(121323(30)2924(27(31)32)178435917)28(33)352516(2)2621(1420(15)25)1910671122(19)3426h35891424H671013H212H3(H2930)(H3132)t24m0s1
O=C(N(C@@H)(c1ccccc1)C(=O)O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2
O=C(NC(c1ccccc1)C(=O)O)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2
ZINC000002108264
ZINC2108264
Check stock
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