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2-{[(1-{4-(benzyloxy)-2-[(tert-butoxycarbonyl)amino]-4-oxobutanoyl}pyrrolidin-2-yl)carbonyl]amino}-5-carbamimidamidopentanoic acid (non-preferred name)

Catalog ID
STL525664
SMILES O=C(CC(C(=O)N1CCCC1C(=O)NC(C(=O)O)CCCNC(=N)N)NC(=O)OC(C)(C)C)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 C27H40N6O8 MW 576.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H40N6O8/c1-27(2,3)41-26(39)32-19(15-21(34)40-16-17-9-5-4-6-10-17)23(36)33-14-8-12-20(33)22(35)31-18(24(37)38)11-7-13-30-25(28)29/h4-6,9-10,18-20H,7-8,11-16H2,1-3H3,(H,31,35)(H,32,39)(H,37,38)(H4,28,29,30)
InChIKey
MMUZQFYGDNUZHS-UHFFFAOYSA-N
Synonyms

2(((1(4(benzyloxy)2((tertbutoxycarbonyl)amino)4oxobutanoyl)pyrrolidin2yl)carbonyl)amino)5carbamimidamidopentanoicacid(nonpreferredname)
222trifluoroaceticacidcompoundwith2(1(4(benzyloxy)2((tertbutoxycarbonyl)amino)4oxobutanoyl)pyrrolidine2carboxamido)5guanidinopentanoicacid(11)
3649099
5(DIAMINOMETHYLIDENEAMINO)2((1(2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)4OXO4PHENYLMETHOXYBUTANOYL)PYRROLIDINE2CARBONYL)AMINO)PENTANOICACID
InChI=1SC27H40N6O8c127(23)4126(39)3219(1521(34)40161795461017)23(36)331481220(33)22(35)3118(24(37)38)117133025(28)29h469101820H781116H213H3(H3135)(H3239)(H3738)(H4282930)
MFCD00468707
OC(=O)C(F)(F)FO=C(CC(C(=O)N1CCCC1C(=O)NC(C(=O)O)CCCNC(=N)N)NC(=O)OC(C)(C)C)OCc1ccccc1
ZINC000070665815
ZINC000252461444

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Available files

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