Vitas-M small molecule compound
(3a'S,6a'R)-5-chloro-3'-(3,4-dihydroxybenzyl)-5'-[2-(3,4-dimethoxyphenyl)ethyl]-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
STL531510
SMILES COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3Cc3ccc(c(c3)O)O)C(=O)Nc3c2cc(Cl)cc3)ccc1OC
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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 C30H28ClN3O7 MW 578.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28ClN3O7/c1-40-23-8-4-15(13-24(23)41-2)9-10-34-27(37)25-20(11-16-3-7-21(35)22(36)12-16)33-30(26(25)28(34)38)18-14-17(31)5-6-19(18)32-29(30)39/h3-8,12-14,20,25-26,33,35-36H,9-11H2,1-2H3,(H,32,39)/t20?,25-,26+,30?/m1/s1InChIKey
OHEMAVIQDGBOJN-MMTSKOGQSA-NSynonyms
956994-24-4(3~(a)~(R)6~(a)~(S))5chloro1((34dihydroxyphenyl)methyl)5(2(34dimethoxyphenyl)ethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)5chloro3(34dihydroxybenzyl)5(2(34dimethoxyphenyl)ethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
(3aS6aR)5chloro3(34dihydroxybenzyl)5(34dimethoxyphenethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
16406250
956994244
COc1cc(CCN2C(=O)(C@H)3(C@@H)(C2=O)C2(NC3Cc3ccc(c(c3)O)O)C(=O)Nc3c2cc(Cl)cc3)ccc1OC
InChI=1SC30H28ClN3O7c140238415(1324(23)412)9103427(37)2520(11163721(35)22(36)1216)3330(26(25)28(34)38)181417(31)5619(18)3229(30)39h381214202526333536H911H212H3(H3239)t20?2526+30?m1s1
MFCD07637542
ZINC000070707316
ZINC000070707325
Check stock
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Check stock on Vitas-MAvailable files
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