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Nalpha-(tert-butoxycarbonyl)-N-{(2S)-1-oxo-1-[(1R,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]propan-2-yl}-D-phenylalaninamide

Catalog ID
STL537377
SMILES O=C(OC(C)(C)C)N[C@@H](C(=O)N[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C)Cc1ccccc1

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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 C28H36N4O5 MW 508.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N4O5/c1-18(26(35)31-15-20-13-21(17-31)23-11-8-12-24(33)32(23)16-20)29-25(34)22(14-19-9-6-5-7-10-19)30-27(36)37-28(2,3)4/h5-12,18,20-22H,13-17H2,1-4H3,(H,29,34)(H,30,36)/t18-,20-,21+,22+/m0/s1
InChIKey
WYVWTHZRFCANJT-VXSCBNMQSA-N
Synonyms

~(tert)butyl~(N)((2~(R))1oxo1(((2~(S))1oxo1((1~(R)9~(S))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)propan2yl)amino)3phenylpropan2yl)carbamate
5581444
InChI=1SC28H36N4O5c118(26(35)3115201321(1731)231181224(33)32(23)1620)2925(34)22(141996571019)3027(36)3728(23)4h512182022H1317H214H3(H2934)(H3036)t182021+22+m0s1
Nalpha(tertbutoxycarbonyl)N((2S)1oxo1((1R5S)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)propan2yl)Dphenylalaninamide
O=C(OC(C)(C)C)N(C@@H)(C(=O)N(C@H)(C(=O)N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1)C)Cc1ccccc1
tertbutyl((R)1oxo1(((S)1oxo1((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)propan2yl)amino)3phenylpropan2yl)carbamate
ZINC000002152606
ZINC2152606

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Available files

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