Vitas-M small molecule compound
(2'R,3S,3aR,8aR,9aR)-8a-methyl-3-((((S)-1-phenylethyl)amino)methyl)decahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one
Catalog ID
STL526310
SMILES C[C@@H](c1ccccc1)NCC1C(=O)O[C@H]2[C@@H]1CC1[C@](C2)(C)CCC[C@]21OC2
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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 C23H31NO3 MW 369.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31NO3/c1-15(16-7-4-3-5-8-16)24-13-18-17-11-20-22(2,12-19(17)27-21(18)25)9-6-10-23(20)14-26-23/h3-5,7-8,15,17-20,24H,6,9-14H2,1-2H3/t15-,17+,18?,19+,20?,22+,23-/m0/s1InChIKey
JQPOKDQOUBIXDQ-ZRRHGEJDSA-NSynonyms
956983-11-2(2R3S3aR8aR9aR)8amethyl3((((S)1phenylethyl)amino)methyl)decahydro2Hspiro(naphtho(23b)furan52oxiran)2one
(3~(a)~(R)5~(R)8~(a)~(R)9~(a)~(R))8~(a)methyl3((((1~(S))1phenylethyl)amino)methyl)spiro(3~(a)44~(a)67899~(a)octahydro3~(H)benzo(f)(1)benzofuran52oxirane)2one
16396925
956983112
C(C@@H)(c1ccccc1)NCC1C(=O)O(C@H)2(C@@H)1CC1(C@)(C2)(C)CCC(C@)21OC2
InChI=1SC23H31NO3c115(167435816)24131817112022(21219(17)2721(18)25)961023(20)142623h357815172024H6914H212H3t1517+18?19+20?22+23m0s1
MFCD32649827
ZINC000004028400
ZINC000012659710
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