Vitas-M small molecule compound

N-[3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-beta-alanine

Catalog ID
STL463499
SMILES O=C(CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1C)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 C20H21NO6 MW 371.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO6/c1-10-9-26-18-12(3)19-15(8-14(10)18)11(2)13(20(25)27-19)4-5-16(22)21-7-6-17(23)24/h8-9H,4-7H2,1-3H3,(H,21,22)(H,23,24)
InChIKey
JAQGBORMWNSUTH-UHFFFAOYSA-N
Synonyms
858770-28-2
3(3(359trimethyl7oxo7Hfuro(32g)chromen6yl)propanamido)propanoicacid
3(3(359TRIMETHYL7OXOFURO(32G)CHROMEN6YL)PROPANOYLAMINO)PROPANOICACID
858770282
CC1=COC2=C(C3=C(C=C12)C(=C(C(=O)O3)CCC(=O)NCCC(=O)O)C)C
InChI=1SC20H21NO6c1109261812(3)1915(814(10)18)11(2)13(20(25)2719)4516(22)217617(23)24h89H47H213H3(H2122)(H2324)
MFCD04146040
N(3(359trimethyl7oxo7Hfuro(32g)chromen6yl)propanoyl)betaalanine
ZINC000002104883
ZINC2104883

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Available files

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