Vitas-M small molecule compound

(1'R,3'R,3a'S,6a'R)-3'-((R)-1-hydroxyethyl)-5'-(4-methoxybenzyl)-3',3a'-dihydro-2'H-spiro[indoline-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(5'H,6a'H)-trione

Catalog ID
STL530926
SMILES COc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)[C@]1(N[C@H]2C(O)C)C(=O)Nc2c1cccc2

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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 C23H23N3O5 MW 421.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O5/c1-12(27)19-17-18(23(25-19)15-5-3-4-6-16(15)24-22(23)30)21(29)26(20(17)28)11-13-7-9-14(31-2)10-8-13/h3-10,12,17-19,25,27H,11H2,1-2H3,(H,24,30)/t12?,17-,18-,19-,23-/m0/s1
InChIKey
KEGUYSHCKXWNRV-SLSOFGESSA-N
Synonyms
956980-44-2
(1~(R)3~(R)3~(a)~(R)6~(a)~(S))1(1hydroxyethyl)5((4methoxyphenyl)methyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(1R3R3aS6aR)3((R)1hydroxyethyl)5(4methoxybenzyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
16403281
956980442
COc1ccc(cc1)CN1C(=O)(C@H)2(C@@H)(C1=O)(C@)1(N(C@H)2C(O)C)C(=O)Nc2c1cccc2
InChI=1SC23H23N3O5c112(27)191718(23(2519)15534616(15)2422(23)30)21(29)26(20(17)28)11137914(312)10813h3101217192527H11H212H3(H2430)t12?17181923m0s1
MFCD32649918
ZINC000015958699
ZINC000020611593

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Available files

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