Vitas-M small molecule compound
(3S,3aR,8aR,9aR)-3-((((4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl)amino)methyl)-5,8a-dimethyl-3,3a,8,8a,9,9a-hexahydronaphtho[2,3-b]furan-2(7H)-one
Catalog ID
STL553448
SMILES O=C1O[C@H]2[C@@H](C1CN[C@H]1COC(O[C@H]1c1ccccc1)(C)C)C=C1[C@](C2)(C)CCC=C1C
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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 C27H35NO4 MW 437.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35NO4/c1-17-9-8-12-27(4)14-23-19(13-21(17)27)20(25(29)31-23)15-28-22-16-30-26(2,3)32-24(22)18-10-6-5-7-11-18/h5-7,9-11,13,19-20,22-24,28H,8,12,14-16H2,1-4H3/t19-,20?,22+,23-,24+,27-/m1/s1InChIKey
GUHALLWLYNNCQT-ZUGONVEYSA-NSynonyms
956975-71-6(3~(a)~(R)8~(a)~(R)9~(a)~(R))3((((4~(S)5~(S))22dimethyl4phenyl13dioxan5yl)amino)methyl)58~(a)dimethyl33~(a)7899~(a)hexahydrobenzo(f)(1)benzofuran2one
(3S3aR8aR9aR)3((((4S5S)22dimethyl4phenyl13dioxan5yl)amino)methyl)58adimethyl33a88a99ahexahydronaphtho(23b)furan2(7H)one
16396964
956975716
InChI=1SC27H35NO4c117981227(4)142319(1321(17)27)20(25(29)3123)152822163026(23)3224(22)18106571118h57911131920222428H8121416H214H3t1920?22+2324+27m1s1
O=C1O(C@H)2(C@@H)(C1CN(C@H)1COC(O(C@H)1c1ccccc1)(C)C)C=C1(C@)(C2)(C)CCC=C1C
ZINC000008762914
ZINC000012659777
Check stock
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