Vitas-M small molecule compound

N-{[(4-butyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-5-hydroxytryptophan

Catalog ID
STL464221
SMILES CCCCc1cc(=O)oc2c1ccc(c2)OCC(=O)NC(C(=O)O)Cc1c[nH]c2c1cc(O)cc2

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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 C26H26N2O7 MW 478.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O7/c1-2-3-4-15-10-25(31)35-23-12-18(6-7-19(15)23)34-14-24(30)28-22(26(32)33)9-16-13-27-21-8-5-17(29)11-20(16)21/h5-8,10-13,22,27,29H,2-4,9,14H2,1H3,(H,28,30)(H,32,33)
InChIKey
PILODEJWJAFZST-UHFFFAOYSA-N
Synonyms
1213978-87-0
1213978870
2((2(4BUTYL2OXOCHROMEN7YL)OXYACETYL)AMINO)3(5HYDROXY1HINDOL3YL)PROPANOICACID
2(2((4butyl2oxo2Hchromen7yl)oxy)acetamido)3(5hydroxy1Hindol3yl)propanoicacid
CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)O
CCCCc1cc(=O)oc2c1ccc(c2)OCC(=O)NC(C(=O)O)Cc1c(nH)c2c1cc(O)cc2
InChI=1SC26H26N2O7c1234151025(31)35231218(6719(15)23)341424(30)2822(26(32)33)9161327218517(29)1120(16)21h581013222729H24914H21H3(H2830)(H3233)
MFCD06495496
N(((4butyl2oxo2Hchromen7yl)oxy)acetyl)5hydroxytryptophan
ZINC000002136699
ZINC000002136701

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.