Methyl 2-([2-((2-[(1-adamantylcarbonyl)amino]-3-methylbutanoyl)amino)-3-methylpentanoyl]amino)propanoate

SpectraBase Compound ID	8dgJrRTUAxM
InChI	InChI=1S/C26H43N3O5/c1-7-15(4)21(23(31)27-16(5)24(32)34-6)28-22(30)20(14(2)3)29-25(33)26-11-17-8-18(12-26)10-19(9-17)13-26/h14-21H,7-13H2,1-6H3,(H,27,31)(H,28,30)(H,29,33)/t15?,16?,17-,18+,19-,20?,21?,26-
InChIKey	OHBNGNLYHLXOME-UHFFFAOYSA-N Google Search
Mol Weight	477.6 g/mol
Molecular Formula	C26H43N3O5
Exact Mass	477.320271 g/mol

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SpectraBase Spectrum ID	FP2scPLvajH
Name	Methyl 2-([2-((2-[(1-adamantylcarbonyl)amino]-3-methylbutanoyl)amino)-3-methylpentanoyl]amino)propanoate
CAS Registry Number	28415-47-6
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C26H43N3O5
InChI	InChI=1S/C26H43N3O5/c1-7-15(4)21(23(31)27-16(5)24(32)34-6)28-22(30)20(14(2)3)29-25(33)26-11-17-8-18(12-26)10-19(9-17)13-26/h14-21H,7-13H2,1-6H3,(H,27,31)(H,28,30)(H,29,33)/t15?,16?,17-,18+,19-,20?,21?,26-
InChIKey	OHBNGNLYHLXOME-UHFFFAOYSA-N
Molecular Weight	477.646 g/mol
SMILES	N(C(=O)C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(C(NC(C(NC(C(OC)=O)C)=O)C(CC)C)=O)C(C)C
SPLASH	splash10-001i-9430000000-d761be2f1e431fa95df2
Source of Spectrum	O-3-797-6
Synonyms	2-[[2-[[2-(adamantane-1-carbonylamino)-3-methyl-butanoyl]amino]-3-methyl-pentanoyl]amino]propionic acid methyl ester 2-[[2-[[2-[[1-adamantyl(oxo)methyl]amino]-3-methyl-1-oxobutyl]amino]-3-methyl-1-oxopentyl]amino]propanoic acid methyl ester Alanine, N-[N-[N-(1-adamantylcarbonyl)-l-valyl]-l-isoleucyl]-, methyl ester, l- Methyl 2-[[2-[[2-(adamantane-1-carbonylamino)-3-methyl-butanoyl]amino]-3-methyl-pentanoyl]amino]propanoate Methyl 2-[[2-[[2-(adamantane-1-carbonylamino)-3-methylbutanoyl]amino]-3-methylpentanoyl]amino]propanoate
Wiley ID	1394535