Vitas-M small molecule compound

(2'S,3S,3'S,10b'R)-3'-(2,2-dimethylpropanoyl)-2'-[(2-methoxyphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one

Catalog ID
STK596391
SMILES COc1ccccc1C(=O)[C@@H]1[C@H](N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C

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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 C32H30N2O4 MW 506.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N2O4/c1-31(2,3)29(36)26-25(27(35)21-13-7-10-16-24(21)38-4)32(22-14-8-9-15-23(22)33-30(32)37)28-20-12-6-5-11-19(20)17-18-34(26)28/h5-18,25-26,28H,1-4H3,(H,33,37)/t25-,26-,28+,32+/m0/s1
InChIKey
NGHOQTKMVGVPIG-CKHSQSCFSA-N
Synonyms
1177688-30-0
(1S2S3S10bR)2(2methoxybenzoyl)3pivaloyl310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)3(22dimethylpropanoyl)2((2methoxyphenyl)carbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)3(22dimethylpropanoyl)2(2methoxybenzoyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1177688300
CC(C)(C)C(=O)C1C(C2(C3N1C=CC4=CC=CC=C34)C5=CC=CC=C5NC2=O)C(=O)C6=CC=CC=C6OC
COc1ccccc1C(=O)(C@@H)1(C@H)(N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C
InChI=1SC32H30N2O4c131(23)29(36)2625(27(35)21137101624(21)384)32(2214891523(22)3330(32)37)282012651119(20)171834(26)28h518252628H14H3(H3337)t252628+32+m0s1
MFCD18246045
ZINC000101330332
ZINC101330332

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Available files

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