Vitas-M small molecule compound
(4E)-1-(furan-2-ylmethyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-5-[3-(3-methylbutoxy)phenyl]pyrrolidine-2,3-dione
Catalog ID
STK561654
SMILES CC(CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1Cc1ccco1)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 C30H31NO6 MW 501.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31NO6/c1-18(2)11-13-36-23-7-4-6-20(16-23)27-26(29(33)30(34)31(27)17-24-8-5-12-35-24)28(32)21-9-10-25-22(15-21)14-19(3)37-25/h4-10,12,15-16,18-19,27,32H,11,13-14,17H2,1-3H3/b28-26+InChIKey
SVXQBIOFEBWELY-BYCLXTJYSA-NSynonyms
577997-24-1(4E)1(furan2ylmethyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)5(3(3methylbutoxy)phenyl)pyrrolidine23dione
577997241
CC(CCOc1cccc(c1)C1C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C(=O)N1Cc1ccco1)C
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)CC4=CC=CO4)C5=CC(=CC=C5)OCCC(C)C)O
InChI=1SC30H31NO6c118(2)1113362374620(1623)2726(29(33)30(34)31(27)172485123524)28(32)219102522(1521)1419(3)3725h41012151618192732H11131417H213H3b2826+
MFCD04079450
ZINC000102076479
ZINC000102076493
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