Vitas-M small molecule compound

N-[(4,8,8-trimethyl-2-oxo-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-3-yl)acetyl]-beta-alanine

Catalog ID
STL522425
SMILES O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)OC(CC1)(C)C)NCCC(=O)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 C20H23NO6 MW 373.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO6/c1-11-13-8-12-4-6-20(2,3)27-15(12)10-16(13)26-19(25)14(11)9-17(22)21-7-5-18(23)24/h8,10H,4-7,9H2,1-3H3,(H,21,22)(H,23,24)
InChIKey
OXJFHPOCYUFVBN-UHFFFAOYSA-N
Synonyms
956951-90-9
16407650
3((2(226trimethyl8oxo34dihydropyrano(32g)chromen7yl)acetyl)amino)propanoicacid
3(2(488trimethyl2oxo2678tetrahydropyrano(32g)chromen3yl)acetamido)propanoicacid
956951909
InChI=1SC20H23NO6c111138124620(23)2715(12)1016(13)2619(25)14(11)917(22)217518(23)24h810H479H213H3(H2122)(H2324)
MFCD08741974
N((488trimethyl2oxo78dihydro2H6Hpyrano(32g)chromen3yl)acetyl)betaalanine
ZINC000008879447
ZINC8879447

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Available files

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