Vitas-M small molecule compound
(2S,5aR,6aR,9S,9aR)-9-(((4-methoxyphenethyl)amino)methyl)-2,5a-dimethyloctahydro-2H-oxireno[2',3':4,4a]naphtho[2,3-b]furan-8(9bH)-one
Catalog ID
STL534584
SMILES COc1ccc(cc1)CCNCC1C(=O)O[C@H]2[C@@H]1C1OC31[C@](C2)(C)CCC[C@@H]3C
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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 C24H33NO4 MW 399.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H33NO4/c1-15-5-4-11-23(2)13-19-20(21-24(15,23)29-21)18(22(26)28-19)14-25-12-10-16-6-8-17(27-3)9-7-16/h6-9,15,18-21,25H,4-5,10-14H2,1-3H3/t15-,18?,19+,20+,21?,23+,24?/m0/s1InChIKey
RWBIPIUHWVWIJW-MIMHXCGISA-NSynonyms
1212488-49-7(2S5aR6aR9S9aR)9(((4methoxyphenethyl)amino)methyl)25adimethyloctahydro2Hoxireno(2344a)naphtho(23b)furan8(9bH)one
(4~(R)8~(R)10~(R)14~(S))5((2(4methoxyphenyl)ethylamino)methyl)1014dimethyl27dioxatetracyclo(8400^(13)0^(48))tetradecan6one
1212488497
16405031
COc1ccc(cc1)CCNCC1C(=O)O(C@H)2(C@@H)1C1OC31(C@)(C2)(C)CCC(C@@H)3C
InChI=1SC24H33NO4c115541123(2)131920(2124(1523)2921)18(22(26)2819)14251210166817(273)9716h6915182125H451014H213H3t1518?19+20+21?23+24?m0s1
MFCD32649983
ZINC000012886065
ZINC000252694924
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