Vitas-M small molecule compound

(3a'S,6a'R)-5'-tert-butyl-3'-(3,4-dihydroxybenzyl)-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
STK594059
SMILES O=C1[C@@H]2C(Cc3ccc(c(c3)O)O)NC3([C@@H]2C(=O)N1C(C)(C)C)C(=O)Nc1c3cccc1

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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 C24H25N3O5 MW 435.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O5/c1-23(2,3)27-20(30)18-15(10-12-8-9-16(28)17(29)11-12)26-24(19(18)21(27)31)13-6-4-5-7-14(13)25-22(24)32/h4-9,11,15,18-19,26,28-29H,10H2,1-3H3,(H,25,32)/t15?,18-,19+,24?/m1/s1
InChIKey
RVFVSGVDHHYGIE-YIYNWQHESA-N
Synonyms
1014086-24-8
(3aR6aS)5tertbutyl1((34dihydroxyphenyl)methyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5(tertbutyl)3(34dihydroxybenzyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5tertbutyl3(34dihydroxybenzyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1014086248
CC(C)(C)N1C(=O)C2C(NC3(C2C1=O)C4=CC=CC=C4NC3=O)CC5=CC(=C(C=C5)O)O
InChI=1SC24H25N3O5c123(23)2720(30)1815(10128916(28)17(29)1112)2624(19(18)21(27)31)13645714(13)2522(24)32h4911151819262829H10H213H3(H2532)t15?1819+24?m1s1
MFCD06792609
O=C1(C@@H)2C(Cc3ccc(c(c3)O)O)NC3((C@@H)2C(=O)N1C(C)(C)C)C(=O)Nc1c3cccc1
ZINC000016024967
ZINC000020566840

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Available files

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