Vitas-M small molecule compound

4-butoxyphenyl 2-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)-3-phenylpropanoate

Catalog ID
STK359365
SMILES CCCCOc1ccc(cc1)OC(=O)C(N1C(=O)C2C(C1=O)C1C=CC2C2C1C2)Cc1ccccc1

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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 C30H31NO5 MW 485.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31NO5/c1-2-3-15-35-19-9-11-20(12-10-19)36-30(34)25(16-18-7-5-4-6-8-18)31-28(32)26-21-13-14-22(24-17-23(21)24)27(26)29(31)33/h4-14,21-27H,2-3,15-17H2,1H3
InChIKey
HUMWHQLCZUNJEO-UHFFFAOYSA-N
Synonyms

4butoxyphenyl2(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)3phenylpropanoate
CCCCOC1=CC=C(C=C1)OC(=O)C(CC2=CC=CC=C2)N3C(=O)C4C5C=CC(C4C3=O)C6C5C6
InChI=1SC30H31NO5c12315351991120(121019)3630(34)25(16187546818)3128(32)2621131422(241723(21)24)27(26)29(31)33h4142127H231517H21H3
MFCD02314675
ZINC000239309728
ZINC000239309731

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Available files

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