Vitas-M small molecule compound

N~5~-carbamoyl-N~2~-{3-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanoyl}-L-ornithine

Catalog ID
STL530595
SMILES NC(=O)NCCC[C@@H](C(=O)O)NC(=O)CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

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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 C20H25N5O6 MW 431.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O6/c21-19(30)22-8-3-6-14(18(28)29)23-16(26)7-9-24-17(27)15-10-12-4-1-2-5-13(12)11-25(15)20(24)31/h1-2,4-5,14-15H,3,6-11H2,(H,23,26)(H,28,29)(H3,21,22,30)/t14-,15-/m0/s1
InChIKey
MILRDBQZNNLONB-GJZGRUSLSA-N
Synonyms
956991-72-3
(2~(S))2(3((10~(a)~(S))13dioxo1010~(a)dihydro5~(H)imidazo(15b)isoquinolin2yl)propanoylamino)5(carbamoylamino)pentanoicacid
(S)2(3((S)13dioxo1010adihydroimidazo(15b)isoquinolin2(1H3H5H)yl)propanamido)5ureidopentanoicacid
16405915
956991723
InChI=1SC20H25N5O6c2119(30)2283614(18(28)29)2316(26)792417(27)151012412513(12)1125(15)20(24)31h12451415H3611H2(H2326)(H2829)(H3212230)t1415m0s1
N~5~carbamoylN~2~(3((10aS)13dioxo151010atetrahydroimidazo(15b)isoquinolin2(3H)yl)propanoyl)Lornithine
NC(=O)NCCC(C@@H)(C(=O)O)NC(=O)CCN1C(=O)(C@H)2N(C1=O)Cc1c(C2)cccc1
ZINC000008876246
ZINC8876246

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Available files

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