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]-L-alanyl-S-benzyl-L-cysteine
Catalog ID
STK580841
SMILES O=C(N[C@H](C(=O)N[C@H](C(=O)O)CSCc1ccccc1)C)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 C32H34N2O7S MW 590.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H34N2O7S/c1-18-21(32(39)41-27-15-28-24(14-23(18)27)22-10-6-7-11-26(22)40-28)12-13-29(35)33-19(2)30(36)34-25(31(37)38)17-42-16-20-8-4-3-5-9-20/h3-5,8-9,14-15,19,25H,6-7,10-13,16-17H2,1-2H3,(H,33,35)(H,34,36)(H,37,38)/t19-,25-/m0/s1InChIKey
XNWNBALSSIJKHX-DFBJGRDBSA-NSynonyms
1014085-57-4(2R)3benzylsulfanyl2(((2S)2(3(4methyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)propanoylamino)propanoyl)amino)propanoicacid
(R)3(benzylthio)2((S)2(3(4methyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)propanamido)propanamido)propanoicacid
1014085574
CC1=C(C(=O)OC2=C1C=C3C4=C(CCCC4)OC3=C2)CCC(=O)NC(C)C(=O)NC(CSCC5=CC=CC=C5)C(=O)O
InChI=1SC32H34N2O7Sc11821(32(39)4127152824(1423(18)27)2210671126(22)4028)121329(35)3319(2)30(36)3425(31(37)38)174216208435920h358914151925H6710131617H212H3(H3335)(H3436)(H3738)t1925m0s1
MFCD18245660
N(3(4methyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)propanoyl)LalanylSbenzylLcysteine
O=C(N(C@H)(C(=O)N(C@H)(C(=O)O)CSCc1ccccc1)C)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
ZINC000097956996
ZINC97956996
Check stock
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