Vitas-M small molecule compound
N-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]-D-tryptophan
Catalog ID
STL464439
SMILES O=C(N[C@@H](C(=O)O)Cc1c[nH]c2c1cccc2)CCc1c(=O)oc2c(c1C)cc1c(c2)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 C30H28N2O6 MW 512.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N2O6/c1-16-18(30(36)38-26-14-27-22(13-21(16)26)20-7-3-5-9-25(20)37-27)10-11-28(33)32-24(29(34)35)12-17-15-31-23-8-4-2-6-19(17)23/h2,4,6,8,13-15,24,31H,3,5,7,9-12H2,1H3,(H,32,33)(H,34,35)/t24-/m1/s1InChIKey
LKXPEEWATMCNST-XMMPIXPASA-NSynonyms
(2R)3(1Hindol3yl)2(3(4methyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)propanoylamino)propanoicacid
(S)3(1Hindol3yl)2(3(4methyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)propanamido)propanoicacid
CC1=C(C(=O)OC2=C1C=C3C4=C(CCCC4)OC3=C2)CCC(=O)NC(CC5=CNC6=CC=CC=C65)C(=O)O
InChI=1SC30H28N2O6c11618(30(36)3826142722(1321(16)26)20735925(20)3727)101128(33)3224(29(34)35)1217153123842619(17)23h246813152431H357912H21H3(H3233)(H3435)t24m1s1
N(3(4methyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)propanoyl)Dtryptophan
O=C(N(C@@H)(C(=O)O)Cc1c(nH)c2c1cccc2)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
O=C(N(C@H)(C(=O)O)Cc1c(nH)c2c1cccc2)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
ZINC000011865670
ZINC11865670
Check stock
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Check stock on Vitas-MAvailable files
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