Vitas-M small molecule compound

(3a'S,6a'R)-5'-cycloheptyl-3'-(1-hydroxyethyl)-5,7-dimethyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione

Catalog ID
STK593020
SMILES Cc1cc(C)c2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C1CCCCCC1)C(O)C)C(=O)N2

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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 C24H31N3O4 MW 425.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31N3O4/c1-12-10-13(2)19-16(11-12)24(23(31)25-19)18-17(20(26-24)14(3)28)21(29)27(22(18)30)15-8-6-4-5-7-9-15/h10-11,14-15,17-18,20,26,28H,4-9H2,1-3H3,(H,25,31)/t14?,17-,18-,20?,24?/m0/s1
InChIKey
UAOHXMBTDCHQGE-KUIXUMEXSA-N
Synonyms
1212438-02-2
(3aR6aS)5cycloheptyl1(1hydroxyethyl)57dimethylspiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5cycloheptyl3(1hydroxyethyl)57dimethyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5cycloheptyl3(1hydroxyethyl)57dimethyl3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1212438022
CC1=CC(=C2C(=C1)C3(C4C(C(N3)C(C)O)C(=O)N(C4=O)C5CCCCCC5)C(=O)N2)C
Cc1cc(C)c2c(c1)C1(NC((C@@H)3(C@H)1C(=O)N(C3=O)C1CCCCCC1)C(O)C)C(=O)N2
InChI=1SC24H31N3O4c1121013(2)1916(1112)24(23(31)2519)1817(20(2624)14(3)28)21(29)27(22(18)30)1586457915h101114151718202628H49H213H3(H2531)t14?171820?24?m0s1
MFCD06771500
ZINC000005205151
ZINC000105347939

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Available files

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