Vitas-M small molecule compound

2-methyl-4-oxo-3-phenoxy-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-L-tryptophanate

Catalog ID
STL464777
SMILES O=C(N[C@H](C(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1)C)Cc1c[nH]c2c1cccc2)OCc1ccccc1

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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 C35H28N2O7 MW 588.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H28N2O7/c1-22-33(43-25-12-6-3-7-13-25)32(38)28-17-16-26(19-31(28)42-22)44-34(39)30(18-24-20-36-29-15-9-8-14-27(24)29)37-35(40)41-21-23-10-4-2-5-11-23/h2-17,19-20,30,36H,18,21H2,1H3,(H,37,40)/t30-/m0/s1
InChIKey
PFXQHNHTUMVXMN-PMERELPUSA-N
Synonyms
1574554-78-1
(2METHYL4OXO3PHENOXYCHROMEN7YL)(2S)3(1HINDOL3YL)2(PHENYLMETHOXYCARBONYLAMINO)PROPANOATE
(S)2methyl4oxo3phenoxy4Hchromen7yl2(((benzyloxy)carbonyl)amino)3(1Hindol3yl)propanoate
1574554781
2methyl4oxo3phenoxy4Hchromen7ylN((benzyloxy)carbonyl)Ltryptophanate
CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)OCC5=CC=CC=C5)OC6=CC=CC=C6
InChI=1SC35H28N2O7c12233(4325126371325)32(38)28171626(1931(28)4222)4434(39)30(182420362915981427(24)29)3735(40)412123104251123h21719203036H1821H21H3(H3740)t30m0s1
MFCD06438986
O=C(N(C@H)(C(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1)C)Cc1c(nH)c2c1cccc2)OCc1ccccc1
ZINC000001876292
ZINC01876292
ZINC1876292

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Available files

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