Vitas-M small molecule compound

tetrahydrofuran-2-ylmethyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate

Catalog ID
STK016059
SMILES O=C(C1=C(C)NC2(C1(O)C(=O)c1c2cccc1)O)OCC1CCCO1

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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 C18H19NO6 MW 345.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO6/c1-10-14(16(21)25-9-11-5-4-8-24-11)17(22)15(20)12-6-2-3-7-13(12)18(17,23)19-10/h2-3,6-7,11,19,22-23H,4-5,8-9H2,1H3
InChIKey
RADGCOZYXYTPNG-UHFFFAOYSA-N
Synonyms
318480-28-3
318480283
3A8ADIHYDROXY2METHYL8OXO33A88ATETRAHYDRO3AZACYCLOPENTA(A)INDENE1CARBOXYLICACIDTETRAHYDROFURAN2YLMETHYLESTER
CC1=C(C2(C(=O)C3=CC=CC=C3C2(N1)O)O)C(=O)OCC4CCCO4
InChI=1SC18H19NO6c11014(16(21)259115482411)17(22)15(20)12623713(12)18(1723)1910h236711192223H4589H21H3
MFCD01445769
O=C(C1=C(C)NC2(C1(O)C(=O)c1c2cccc1)O)OCC1CCCO1
OXOLAN2YLMETHYL3A8BDIHYDROXY2METHYL4OXO1HINDENO(12B)PYRROLE3CARBOXYLATE
OXOLAN2YLMETHYL3A8BDIHYDROXY2METHYL4OXOINDANO(21D)2PYRROLINE3CARBOXYLATE
STK016059
TETRAHYDRO2FURANYLMETHYL3A8BDIHYDROXY2METHYL4OXO13A48BTETRAHYDROINDENO(12B)PYRROLE3CARBOXYLATE
TETRAHYDROFURAN2YLMETHYL3A8BDIHYDROXY2METHYL4OXO13A48BTETRAHYDROINDENO(12B)PYRROLE3CARBOXYLATE
ZINC000019789161
ZINC000035973769

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.