Vitas-M small molecule compound

3-methylphenyl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxyhexopyranoside

Catalog ID
STL558256
SMILES CC(=O)OCC1OC(Oc2cccc(c2)C)C(C(C1OC(=O)C)OC(=O)C)NC(=O)C

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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 C21H27NO9 MW 437.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27NO9/c1-11-7-6-8-16(9-11)30-21-18(22-12(2)23)20(29-15(5)26)19(28-14(4)25)17(31-21)10-27-13(3)24/h6-9,17-21H,10H2,1-5H3,(H,22,23)
InChIKey
LERJREBRRWXADA-UHFFFAOYSA-N
Synonyms
1094812-65-3
(2R3S4R5R6S)5acetamido2(acetoxymethyl)6(mtolyloxy)tetrahydro2Hpyran34diyldiacetate
(34BIS(ACETYLOXY)5ACETAMIDO6(3METHYLPHENOXY)OXAN2YL)METHYLACETATE
(5ACETAMIDO34DIACETYLOXY6(3METHYLPHENOXY)OXAN2YL)METHYLACETATE
1094812653
3691966
3methylphenyl346triOacetyl2(acetylamino)2deoxyhexopyranoside
5ACETAMIDO2(ACETOXYMETHYL)6(MTOLYLOXY)TETRAHYDRO2HPYRAN34DIYLDIACETATE
CC(=O)OC(C@H)1O(C@@H)(Oc2cccc(c2)C)(C@@H)((C@H)((C@@H)1OC(=O)C)OC(=O)C)NC(=O)C
InChI=1SC21H27NO9c11176816(911)302118(2212(2)23)20(2915(5)26)19(2814(4)25)17(3121)102713(3)24h691721H10H215H3(H2223)
MFCD02296254
ZINC000083260827
ZINC000245225745

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Available files

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