Vitas-M small molecule compound
[1,5-dinitro-6-oxo-11-(2-oxopropyl)-1,4,5,6-tetrahydro-1,5-methano-3-benzazocin-3(2H)-yl]acetic acid
Catalog ID
STK680071
SMILES OC(=O)CN1CC2([N+](=O)[O-])C(=O)c3c(C(C1)(C2CC(=O)C)[N+](=O)[O-])cccc3
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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 C17H17N3O8 MW 391.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O8/c1-10(21)6-13-16(19(25)26)8-18(7-14(22)23)9-17(13,20(27)28)15(24)11-4-2-3-5-12(11)16/h2-5,13H,6-9H2,1H3,(H,22,23)InChIKey
HVIDBGGUKKEKKI-UHFFFAOYSA-NSynonyms
(15dinitro6oxo11(2oxopropyl)1456tetrahydro15methano3benzazocin3(2H)yl)aceticacid
CC(=O)CC1C2(C(NH+)(CC1(C(=O)C3=CC=CC=C32)(N+)(=O)(O))CC(=O)(O))(N+)(=O)(O)
InChI=1SC17H17N3O8c110(21)61316(19(25)26)818(714(22)23)917(1320(27)28)15(24)11423512(11)16h2513H69H21H3(H2223)
MFCD03764444
OC(=O)CN1CC2((N+)(=O)(O))C(=O)c3c(C(C1)(C2CC(=O)C)(N+)(=O)(O))cccc3
ZINC000169712703
ZINC000169712704
Check stock
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