Vitas-M small molecule compound
N-({1-[N-(tert-butoxycarbonyl)-L-tryptophyl]piperidin-4-yl}carbonyl)-S-(carboxymethyl)-L-cysteine
Catalog ID
STL541453
SMILES OC(=O)CSC[C@@H](C(=O)O)NC(=O)C1CCN(CC1)C(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)OC(C)(C)C
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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 C27H36N4O8S MW 576.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H36N4O8S/c1-27(2,3)39-26(38)30-20(12-17-13-28-19-7-5-4-6-18(17)19)24(35)31-10-8-16(9-11-31)23(34)29-21(25(36)37)14-40-15-22(32)33/h4-7,13,16,20-21,28H,8-12,14-15H2,1-3H3,(H,29,34)(H,30,38)(H,32,33)(H,36,37)/t20-,21-/m0/s1InChIKey
JIORGIGPIRRFLK-SFTDATJTSA-NSynonyms
956928-43-1(2~(R))3(carboxymethylsulfanyl)2((1((2~(S))3(1~(H)indol3yl)2((2methylpropan2yl)oxycarbonylamino)propanoyl)piperidine4carbonyl)amino)propanoicacid
(R)2(1((S)2((tertbutoxycarbonyl)amino)3(1Hindol3yl)propanoyl)piperidine4carboxamido)3((carboxymethyl)thio)propanoicacid
16400276
956928431
InChI=1SC27H36N4O8Sc127(23)3926(38)3020(1217132819754618(17)19)24(35)3110816(91131)23(34)2921(25(36)37)14401522(32)33h471316202128H8121415H213H3(H2934)(H3038)(H3233)(H3637)t2021m0s1
N((1(N(tertbutoxycarbonyl)Ltryptophyl)piperidin4yl)carbonyl)S(carboxymethyl)Lcysteine
OC(=O)CSC(C@@H)(C(=O)O)NC(=O)C1CCN(CC1)C(=O)(C@H)(Cc1c(nH)c2c1cccc2)NC(=O)OC(C)(C)C
ZINC000070687261
ZINC70687261
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.