Vitas-M small molecule compound
(2'S,3S,3'S,10b'R)-3'-[(4-methylphenyl)carbonyl]-2'-{[4-(prop-2-en-1-yloxy)phenyl]carbonyl}-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Catalog ID
STK575707
SMILES C=CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2
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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 C37H30N2O4 MW 566.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H30N2O4/c1-3-22-43-27-18-16-25(17-19-27)33(40)31-32(34(41)26-14-12-23(2)13-15-26)39-21-20-24-8-4-5-9-28(24)35(39)37(31)29-10-6-7-11-30(29)38-36(37)42/h3-21,31-32,35H,1,22H2,2H3,(H,38,42)/t31-,32-,35+,37+/m0/s1InChIKey
AFGOANOJBNJNCP-UMKORLBGSA-NSynonyms
1212177-74-6(1S2S3S10bR)2(4(allyloxy)benzoyl)3(4methylbenzoyl)310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)3((4methylphenyl)carbonyl)2((4(prop2en1yloxy)phenyl)carbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)3(4methylbenzoyl)2(4prop2enoxybenzoyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1212177746
C=CCOc1ccc(cc1)C(=O)(C@@H)1(C@@H)(C(=O)c2ccc(cc2)C)N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2
CC1=CC=C(C=C1)C(=O)C2C(C3(C4N2C=CC5=CC=CC=C45)C6=CC=CC=C6NC3=O)C(=O)C7=CC=C(C=C7)OCC=C
InChI=1SC37H30N2O4c13224327181625(171927)33(40)3132(34(41)26141223(2)131526)39212024845928(24)35(39)37(31)2910671130(29)3836(37)42h321313235H122H22H3(H3842)t313235+37+m0s1
MFCD18158079
ZINC000101293694
ZINC101293694
Check stock
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Check stock on Vitas-MAvailable files
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