Vitas-M small molecule compound

(1'S,2'S,3R,3a'R)-1'-(2,2-dimethylpropanoyl)-2'-(furan-2-ylcarbonyl)-7'-methoxy-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one

Catalog ID
STK558543
SMILES COc1ccc2c(c1)C=C[C@H]1N2[C@H](C(=O)C(C)(C)C)[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccco1

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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 C30H28N2O5 MW 496.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N2O5/c1-29(2,3)27(34)25-24(26(33)22-10-7-15-37-22)30(19-8-5-6-9-20(19)31-28(30)35)23-14-11-17-16-18(36-4)12-13-21(17)32(23)25/h5-16,23-25H,1-4H3,(H,31,35)/t23-,24+,25+,30-/m1/s1
InChIKey
PYCQOOQIHFELCV-UBRKHCEVSA-N
Synonyms
1177666-48-6
(1S2S3R3aR)1(22dimethylpropanoyl)2(furan2carbonyl)7methoxyspiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
(1S2S3R3aR)1(22dimethylpropanoyl)2(furan2ylcarbonyl)7methoxy12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1S2S3R3aR)2(furan2carbonyl)7methoxy1pivaloyl23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1177666486
CC(C)(C)C(=O)C1C(C2(C3N1C4=C(C=C3)C=C(C=C4)OC)C5=CC=CC=C5NC2=O)C(=O)C6=CC=CO6
COc1ccc2c(c1)C=C(C@H)1N2(C@H)(C(=O)C(C)(C)C)(C@H)((C@@)21C(=O)Nc1c2cccc1)C(=O)c1ccco1
InChI=1SC30H28N2O5c129(23)27(34)2524(26(33)22107153722)30(19856920(19)3128(30)35)231411171618(364)121321(17)32(23)25h5162325H14H3(H3135)t2324+25+30m1s1
MFCD18243095
ZINC000009191254
ZINC09191254
ZINC9191254

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Available files

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