Vitas-M small molecule compound
(5S,6R)-5-ethyl-3,3-dimethyl-6-(4-nitrophenyl)dihydro-2H-pyran-2,4(3H)-dione
Catalog ID
STK838781
SMILES CC[C@H]1[C@@H](OC(=O)C(C1=O)(C)C)c1ccc(cc1)[N+](=O)[O-]
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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 C15H17NO5 MW 291.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17NO5/c1-4-11-12(21-14(18)15(2,3)13(11)17)9-5-7-10(8-6-9)16(19)20/h5-8,11-12H,4H2,1-3H3/t11-,12-/m0/s1InChIKey
LCBGEFYZUIYPGO-RYUDHWBXSA-NSynonyms
(5S6R)5ethyl33dimethyl6(4nitrophenyl)dihydro2Hpyran24(3H)dione
(5S6R)5ETHYL33DIMETHYL6(4NITROPHENYL)OXANE24DIONE
CC(C@H)1(C@@H)(OC(=O)C(C1=O)(C)C)c1ccc(cc1)(N+)(=O)(O)
CCC1C(OC(=O)C(C1=O)(C)C)C2=CC=C(C=C2)(N+)(=O)(O)
InChI=1SC15H17NO5c141112(2114(18)15(23)13(11)17)95710(869)16(19)20h581112H4H213H3t1112m0s1
MFCD18247015
ZINC000000171443
ZINC00171443
ZINC171443
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