Vitas-M small molecule compound

10'-[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]-9',10'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[2,3-f]chromene]-4',8'(3'H)-dione

Catalog ID
STL544153
SMILES COc1ccc(cc1)c1[nH]ncc1C1CC(=O)Oc2c1c1OC3(CCCCC3)CC(=O)c1cc2

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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 C27H26N2O5 MW 458.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O5/c1-32-17-7-5-16(6-8-17)25-20(15-28-29-25)19-13-23(31)33-22-10-9-18-21(30)14-27(11-3-2-4-12-27)34-26(18)24(19)22/h5-10,15,19H,2-4,11-14H2,1H3,(H,28,29)
InChIKey
BFFBTKZXTKZCCE-UHFFFAOYSA-N
Synonyms
1676078-78-6
10(3(4methoxyphenyl)1Hpyrazol4yl)910dihydro3Hspiro(cyclohexane12pyrano(23f)chromene)48dione
10(5(4methoxyphenyl)1~(H)pyrazol4yl)spiro(910dihydro3~(H)pyrano(23f)chromene21cyclohexane)48dione
10(5(4methoxyphenyl)1Hpyrazol4yl)910dihydro8Hspiro(cyclohexane12pyrano(23f)chromene)48(3H)dione
102564578
1676078786
COc1ccc(cc1)c1n(nH)cc1C1CC(=O)Oc2c1c1OC3(CCCCC3)CC(=O)c1cc2
InChI=1SC27H26N2O5c132177516(6817)2520(15282925)191323(31)33221091821(30)1427(113241227)3426(18)24(19)22h5101519H241114H21H3(H2829)
MFCD31755991
ZINC000217976163
ZINC000217976242

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Available files

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