Vitas-M small molecule compound

N~5~-carbamoyl-N~2~-(2-{[(3,5-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)acetyl]amino}butanoyl)-D-ornithine

Catalog ID
STL532600
SMILES CCC(C(=O)N[C@@H](C(=O)O)CCCNC(=O)N)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C

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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 C25H30N4O8 MW 514.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O8/c1-4-17(22(31)29-18(23(32)33)6-5-7-27-25(26)35)28-21(30)9-16-13(3)15-8-14-12(2)11-36-19(14)10-20(15)37-24(16)34/h8,10-11,17-18H,4-7,9H2,1-3H3,(H,28,30)(H,29,31)(H,32,33)(H3,26,27,35)/t17?,18-/m1/s1
InChIKey
ARWAPRUODJTGAG-QRWMCTBCSA-N
Synonyms
1029938-92-8
(2~(R))5(carbamoylamino)2(2((2(35dimethyl7oxofuro(32g)chromen6yl)acetyl)amino)butanoylamino)pentanoicacid
(2R)2(2(2(35dimethyl7oxo7Hfuro(32g)chromen6yl)acetamido)butanamido)5ureidopentanoicacid
1029938928
16406161
CCC(C(=O)N(C@@H)(C(=O)O)CCCNC(=O)N)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1C
InChI=1SC25H30N4O8c1417(22(31)2918(23(32)33)6572725(26)35)2821(30)91613(3)1581412(2)113619(14)1020(15)3724(16)34h810111718H479H213H3(H2830)(H2931)(H3233)(H3262735)t17?18m1s1
MFCD08002470
N~5~carbamoylN~2~(2(((35dimethyl7oxo7Hfuro(32g)chromen6yl)acetyl)amino)butanoyl)Dornithine
N5CARBAMOYLN2(2(((35DIMETHYL7OXO7HFURO(32G)CHROMEN6YL)ACETYL)AMINO)BUTANOYL)DORNITHINE
ZINC000008876349
ZINC000008876351

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Available files

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