Vitas-M small molecule compound

2-{[(6'-methyl-8'-oxo-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-7'-yl)acetyl]amino}butanoic acid

Catalog ID
STL350221
SMILES CCC(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)OC2(CC1)CCCCC2

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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 C24H29NO6 MW 427.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29NO6/c1-3-18(22(27)28)25-21(26)12-17-14(2)16-11-15-7-10-24(8-5-4-6-9-24)31-19(15)13-20(16)30-23(17)29/h11,13,18H,3-10,12H2,1-2H3,(H,25,26)(H,27,28)
InChIKey
WGPMCSNYNDGCAT-UHFFFAOYSA-N
Synonyms
1050276-67-9
1050276679
2(((6methyl8oxo34dihydro8Hspiro(cyclohexane12pyrano(32g)chromen)7yl)acetyl)amino)butanoicacid
2((2(6methyl8oxospiro(34dihydropyrano(32g)chromene21cyclohexane)7yl)acetyl)amino)butanoicacid
2(2(6methyl8oxo48dihydro3Hspiro(cyclohexane12pyrano(32g)chromen)7yl)acetamido)butanoicacid
CCC(C(=O)O)NC(=O)CC1=C(C2=CC3=C(C=C2OC1=O)OC4(CCCCC4)CC3)C
InChI=1SC24H29NO6c1318(22(27)28)2521(26)121714(2)16111571024(8546924)3119(15)1320(16)3023(17)29h111318H31012H212H3(H2526)(H2728)
MFCD08749201
ZINC000013629244
ZINC000013629247

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Available files

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