Vitas-M small molecule compound
(3S,6R,9S,12S)-3,6,9-trimethyloctahydro-3,12-epoxy[1,2]dioxepino[4,3-i]isochromen-10(3H)-one
Catalog ID
STK722198
SMILES O=C1O[C@@H]2O[C@]3(C)CCC4C2(C([C@@H]1C)CC[C@H]4C)OO3
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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 C15H22O5 MW 282.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3/t8-,9+,10?,11?,13-,14+,15?/m1/s1InChIKey
BLUAFEHZUWYNDE-GRYHFFAWSA-NSynonyms
(3S6R9S12S)369trimethyloctahydro312epoxy(12)dioxepino(43i)isochromen10(3H)one
(5AS6R8AS9R12S12AR)369TRIMETHYLOCTAHYDRO312EPOXY(12)DIOXEPINO(43I)ISOCHROMEN10(3H)ONE
CC1CCC2C(C(=O)OC3C24C1CCC(O3)(OO4)C)C
InChI=1SC15H22O5c1845119(2)12(16)171315(11)10(8)6714(31813)192015h81113H47H213H3t89+10?11?1314+15?m1s1
O=C1O(C@@H)2O(C@)3(C)CCC4C2(C((C@@H)1C)CC(C@H)4C)OO3
ZINC000101209871
ZINC000102685088
Check stock
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