Vitas-M small molecule compound
2-methylpropyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate
Catalog ID
STK326245
SMILES CC(COC(=O)C1=C(C)NC2(C1(O)C(=O)c1c2cccc1)O)C
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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 C17H19NO5 MW 317.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO5/c1-9(2)8-23-15(20)13-10(3)18-17(22)12-7-5-4-6-11(12)14(19)16(13,17)21/h4-7,9,18,21-22H,8H2,1-3H3InChIKey
KKSGPNXLNMLXTO-UHFFFAOYSA-NSynonyms
2METHYLPROPYL3A8BDIHYDROXY2METHYL4OXO13A48BTETRAHYDROINDENO(12B)PYRROLE3CARBOXYLATE
2methylpropyl3a8bdihydroxy2methyl4oxo1Hindeno(12b)pyrrole3carboxylate
3A8ADIHYDROXY2METHYL8OXO33A88ATETRAHYDRO3AZACYCLOPENTA(A)INDENE1CARBOXYLICACIDISOBUTYLESTER
CC1=C(C2(C(=O)C3=CC=CC=C3C2(N1)O)O)C(=O)OCC(C)C
InChI=1SC17H19NO5c19(2)82315(20)1310(3)1817(22)12754611(12)14(19)16(1317)21h479182122H8H213H3
ISOBUTYL3A8BDIHYDROXY2METHYL4OXO13A48BTETRAHYDROINDENO(12B)PYRROLE3CARBOXYLATE
MFCD01445326
ZINC000004157032
ZINC000008684269
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