Vitas-M small molecule compound

(4E)-4-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-1-(5-methyl-1,2-oxazol-3-yl)-5-(3,4,5-trimethoxyphenyl)pyrrolidine-2,3-dione

Catalog ID
STK617804
SMILES COc1cc(cc(c1OC)OC)C1N(c2noc(c2)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC(C)C)/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 C27H28N2O8 MW 508.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O8/c1-14(2)36-18-9-7-16(8-10-18)24(30)22-23(17-12-19(33-4)26(35-6)20(13-17)34-5)29(27(32)25(22)31)21-11-15(3)37-28-21/h7-14,23,30H,1-6H3/b24-22+
InChIKey
ZCJRIYOXGBKOAT-ZNTNEXAZSA-N
Synonyms
618877-18-2
(4E)4(hydroxy(4(propan2yloxy)phenyl)methylidene)1(5methyl12oxazol3yl)5(345trimethoxyphenyl)pyrrolidine23dione
(4E)4(HYDROXY(4PROPAN2YLOXYPHENYL)METHYLIDENE)1(5METHYL12OXAZOL3YL)5(345TRIMETHOXYPHENYL)PYRROLIDINE23DIONE
3HYDROXY4((4(METHYLETHOXY)PHENYL)CARBONYL)1(5METHYLISOXAZOL3YL)5(345TRIMETHOXYPHENYL)3PYRROLIN2ONE
618877182
CC1=CC(=NO1)N2C(C(=C(C3=CC=C(C=C3)OC(C)C)O)C(=O)C2=O)C4=CC(=C(C(=C4)OC)OC)OC
COc1cc(cc(c1OC)OC)C1N(c2noc(c2)C)C(=O)C(=O)C1=C(c1ccc(cc1)OC(C)C)O
InChI=1SC27H28N2O8c114(2)36189716(81018)24(30)2223(171219(334)26(356)20(1317)345)29(27(32)25(22)31)211115(3)372821h7142330H16H3b2422+
MFCD09798152
ZINC000102717026
ZINC000102717029

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Available files

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