Vitas-M small molecule compound
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl N-(tert-butoxycarbonyl)-D-tryptophanate
Catalog ID
STL565466
SMILES O=C(OC(C)(C)C)N[C@@H](C(=O)Oc1ccc2c(c1)oc(c(c2=O)c1ccc2c(c1)OCCCO2)C)Cc1c[nH]c2c1cccc2
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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 C35H34N2O8 MW 610.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H34N2O8/c1-20-31(21-10-13-28-30(17-21)42-15-7-14-41-28)32(38)25-12-11-23(18-29(25)43-20)44-33(39)27(37-34(40)45-35(2,3)4)16-22-19-36-26-9-6-5-8-24(22)26/h5-6,8-13,17-19,27,36H,7,14-16H2,1-4H3,(H,37,40)/t27-/m1/s1InChIKey
ORGVYSONNBFESV-HHHXNRCGSA-NSynonyms
956818-32-9(3(34dihydro2H15benzodioxepin7yl)2methyl4oxochromen7yl)(2R)3(1Hindol3yl)2((2methylpropan2yl)oxycarbonylamino)propanoate
(R)3(34DIHYDRO2HBENZO(B)(14)DIOXEPIN7YL)2METHYL4OXO4HCHROMEN7YL2((TERTBUTOXYCARBONYL)AMINO)3(1HINDOL3YL)PROPANOATE
16396237
3(34dihydro2H15benzodioxepin7yl)2methyl4oxo4Hchromen7ylN(tertbutoxycarbonyl)Dtryptophanate
956818329
InChI=1SC35H34N2O8c12031(2110132830(1721)42157144128)32(38)25121123(1829(25)4320)4433(39)27(3734(40)4535(23)4)1622193626965824(22)26h5681317192736H71416H214H3(H3740)t27m1s1
MFCD01548261
O=C(OC(C)(C)C)N(C@@H)(C(=O)Oc1ccc2c(c1)oc(c(c2=O)c1ccc2c(c1)OCCCO2)C)Cc1c(nH)c2c1cccc2
ZINC000070669775
Check stock
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