Vitas-M small molecule compound

N-[(2,5-dimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)acetyl]-D-valine

Catalog ID
STL464084
SMILES O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1c1ccccc1)C)N[C@@H](C(=O)O)C(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 C26H25NO6 MW 447.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25NO6/c1-13(2)24(25(29)30)27-22(28)11-18-14(3)17-10-19-21(12-20(17)33-26(18)31)32-15(4)23(19)16-8-6-5-7-9-16/h5-10,12-13,24H,11H2,1-4H3,(H,27,28)(H,29,30)/t24-/m1/s1
InChIKey
AVIBNPAURSHTAY-XMMPIXPASA-N
Synonyms

(2R)2((2(25dimethyl7oxo3phenylfuro(32g)chromen6yl)acetyl)amino)3methylbutanoicacid
(S)2(2(25dimethyl7oxo3phenyl7Hfuro(32g)chromen6yl)acetamido)3methylbutanoicacid
CC1=C(C(=O)OC2=C1C=C3C(=C2)OC(=C3C4=CC=CC=C4)C)CC(=O)NC(C(C)C)C(=O)O
InChI=1SC26H25NO6c113(2)24(25(29)30)2722(28)111814(3)17101921(1220(17)3326(18)31)3215(4)23(19)168657916h510121324H11H214H3(H2728)(H2930)t24m1s1
N((25dimethyl7oxo3phenyl7Hfuro(32g)chromen6yl)acetyl)Dvaline
O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1c1ccccc1)C)N(C@@H)(C(=O)O)C(C)C
O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1c1ccccc1)C)N(C@H)(C(=O)O)C(C)C
ZINC000011865582
ZINC11865582

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Available files

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