Vitas-M small molecule compound
3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one
Catalog ID
STL566262
SMILES OCC1O[C@@H](Oc2cc3occ(c(=O)c3cc2CC)c2ccc3c(c2)OCO3)C(C([C@H]1O)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 C24H24O10 MW 472.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24O10/c1-2-11-5-13-17(7-16(11)33-24-23(29)22(28)21(27)19(8-25)34-24)30-9-14(20(13)26)12-3-4-15-18(6-12)32-10-31-15/h3-7,9,19,21-25,27-29H,2,8,10H2,1H3/t19?,21-,22?,23?,24+/m1/s1InChIKey
DAWHFJMVWWCEIH-YLLXYKFWSA-NSynonyms
16395977
3(13benzodioxol5yl)6ethyl7((2R5S)345trihydroxy6(hydroxymethyl)oxan2yl)oxychromen4one
3(BENZO(D)(13)DIOXOL5YL)6ETHYL7(((2R3R4S5S6R)345TRIHYDROXY6(HYDROXYMETHYL)TETRAHYDRO2HPYRAN2YL)OXY)4HCHROMEN4ONE
InChI=1SC24H24O10c121151317(716(11)332423(29)22(28)21(27)19(825)3424)30914(20(13)26)12341518(612)32103115h3791921252729H2810H21H3t19?2122?23?24+m1s1
MFCD01081758
OCC1O(C@H)(Oc2cc3occ(c(=O)c3cc2CC)c2ccc3c(c2)OCO3)C(C((C@@H)1O)O)O
ZINC000012656880
ZINC000217368454
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