Vitas-M small molecule compound
3-(6-hydroxy-1,3-benzodioxol-5-yl)-N-[(2R)-2-hydroxypropyl]-3-(4-oxo-4H-chromen-3-yl)propanamide
Catalog ID
STL550964
SMILES CC(CNC(=O)CC(c1coc2c(c1=O)cccc2)c1cc2OCOc2cc1O)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 C22H21NO7 MW 411.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO7/c1-12(24)9-23-21(26)7-14(15-6-19-20(8-17(15)25)30-11-29-19)16-10-28-18-5-3-2-4-13(18)22(16)27/h2-6,8,10,12,14,24-25H,7,9,11H2,1H3,(H,23,26)/t12-,14?/m1/s1InChIKey
OFDABAZOSZETQV-PUODRLBUSA-NSynonyms
129895261
3(6hydroxy13benzodioxol5yl)~(N)((2~(R))2hydroxypropyl)3(4oxochromen3yl)propanamide
3(6hydroxy13benzodioxol5yl)N((2R)2hydroxypropyl)3(4oxo4Hchromen3yl)propanamide
3(6hydroxybenzo(d)(13)dioxol5yl)N((R)2hydroxypropyl)3(4oxo4Hchromen3yl)propanamide
C(C@H)(CNC(=O)CC(c1coc2c(c1=O)cccc2)c1cc2OCOc2cc1O)O
InChI=1SC22H21NO7c112(24)92321(26)714(1561920(817(15)25)30112919)16102818532413(18)22(16)27h2681012142425H7911H21H3(H2326)t1214?m1s1
ZINC000524730583
ZINC000524730584
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