Vitas-M small molecule compound
(3a'S,6a'R)-3'-(4-hydroxybenzyl)-5'-(2-methoxybenzyl)-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
STL533064
SMILES COc1ccccc1CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)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 C28H25N3O5 MW 483.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O5/c1-36-22-9-5-2-6-17(22)15-31-25(33)23-21(14-16-10-12-18(32)13-11-16)30-28(24(23)26(31)34)19-7-3-4-8-20(19)29-27(28)35/h2-13,21,23-24,30,32H,14-15H2,1H3,(H,29,35)/t21?,23-,24+,28?/m1/s1InChIKey
KFBIRVXIQRCULY-OGVVDZCPSA-NSynonyms
956973-93-6(3~(a)~(R)6~(a)~(S))1((4hydroxyphenyl)methyl)5((2methoxyphenyl)methyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)3(4hydroxybenzyl)5(2methoxybenzyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)3(4hydroxybenzyl)5(2methoxybenzyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
16403011
956973936
COc1ccccc1CN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cccc2
InChI=1SC28H25N3O5c13622952617(22)153125(33)2321(1416101218(32)131116)3028(24(23)26(31)34)19734820(19)2927(28)35h2132123243032H1415H21H3(H2935)t21?2324+28?m1s1
MFCD06494883
ZINC000015958195
ZINC000020611335
Check stock
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Check stock on Vitas-MAvailable files
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