Vitas-M small molecule compound

(3a'S,6a'R)-3'-[(5-hydroxy-1H-indol-3-yl)methyl]-5-methyl-5'-phenyl-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
STL535344
SMILES Cc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1ccccc1)Cc1c[nH]c3c1cc(O)cc3)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 C29H24N4O4 MW 492.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N4O4/c1-15-7-9-22-20(11-15)29(28(37)31-22)25-24(26(35)33(27(25)36)17-5-3-2-4-6-17)23(32-29)12-16-14-30-21-10-8-18(34)13-19(16)21/h2-11,13-14,23-25,30,32,34H,12H2,1H3,(H,31,37)/t23?,24-,25+,29?/m1/s1
InChIKey
DNLOATWUMHBQPK-SIAIGSQXSA-N
Synonyms
1014079-83-4
(3~(a)~(R)6~(a)~(S))1((5hydroxy1~(H)indol3yl)methyl)5methyl5phenylspiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)3((5hydroxy1Hindol3yl)methyl)5methyl5phenyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)3((5hydroxy1Hindol3yl)methyl)5methyl5phenyl3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1014079834
17572180
Cc1ccc2c(c1)C1(NC((C@@H)3(C@H)1C(=O)N(C3=O)c1ccccc1)Cc1c(nH)c3c1cc(O)cc3)C(=O)N2
InChI=1SC29H24N4O4c115792220(1115)29(28(37)3122)2524(26(35)33(27(25)36)175324617)23(3229)121614302110818(34)1319(16)21h21113142325303234H12H21H3(H3137)t23?2425+29?m1s1
MFCD09843863
ZINC000035365995
ZINC000035366001

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Available files

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