Vitas-M small molecule compound
(3a'R,5'R,6'S,6a'R)-6'-propoxy-5'-((R)-1,4-dioxaspiro[4.5]decan-2-yl)tetrahydrospiro[cyclohexane-1,2'-furo[2,3-d][1,3]dioxole]
Catalog ID
STL570092
SMILES CCCO[C@H]1[C@H](O[C@H]2[C@@H]1OC1(O2)CCCCC1)C1COC2(O1)CCCCC2
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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 C21H34O6 MW 382.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H34O6/c1-2-13-22-17-16(15-14-23-20(25-15)9-5-3-6-10-20)24-19-18(17)26-21(27-19)11-7-4-8-12-21/h15-19H,2-14H2,1H3/t15?,16-,17+,18-,19-/m1/s1InChIKey
RHQNYCLFCSCTDW-BMSWRWNDSA-NSynonyms
294183-72-5(3aR5R6S6aR)5(14dioxaspiro(45)decan3yl)6propoxyspiro(3a566atetrahydrofuro(23d)(13)dioxole21cyclohexane)
(3aR5R6S6aR)6propoxy5((R)14dioxaspiro(45)decan2yl)tetrahydrospiro(cyclohexane12furo(23d)(13)dioxole)
16396861
294183725
CCCO(C@H)1(C@H)(O(C@H)2(C@@H)1OC1(O2)CCCCC1)C1COC2(O1)CCCCC2
InChI=1SC21H34O6c1213221716(15142320(2515)95361020)241918(17)2621(2719)117481221h1519H214H21H3t15?1617+1819m1s1
MFCD32649534
ZINC000004028175
ZINC000012659555
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