Vitas-M small molecule compound

[(1S,7aR)-1-hydroxy-2,3,5,7a-tetrahydro-1H-pyrrolizin-7-yl]methyl 2,3-dihydroxy-2-(propan-2-yl)butanoate

Catalog ID
STL564432
SMILES O[C@H]1CCN2[C@@H]1C(=CC2)COC(=O)C(C(O)C)(C(C)C)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 C15H25NO5 MW 299.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H25NO5/c1-9(2)15(20,10(3)17)14(19)21-8-11-4-6-16-7-5-12(18)13(11)16/h4,9-10,12-13,17-18,20H,5-8H2,1-3H3/t10?,12-,13+,15?/m0/s1
InChIKey
SFVVQRJOGUKCEG-HFAULKRZSA-N
Synonyms

((1S7aR)1hydroxy2357atetrahydro1Hpyrrolizin7yl)methyl23dihydroxy2(propan2yl)butanoate
((7S8R)7hydroxy5678tetrahydro3Hpyrrolizin1yl)methyl2hydroxy2(1hydroxyethyl)3methylbutanoate
(2R3S)((1R7aR)1hydroxy2357atetrahydro1Hpyrrolizin7yl)methyl23dihydroxy2isopropylbutanoate
21627977
ECHINATINE
InChI=1SC15H25NO5c19(2)15(2010(3)17)14(19)2181146167512(18)13(11)16h49101213171820H58H213H3t10?1213+15?m0s1
MFCD32651468
O(C@@H)1CCN2(C@@H)1C(=CC2)COC(=O)(C@)((C@@H)(O)C)(C(C)C)O
ZINC000000899270
ZINC000005481951

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Available files

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