Vitas-M small molecule compound

(6aR,6bS,9aR,10S)-8-(2,5-dimethoxyphenyl)-10-(phenylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione

Catalog ID
STL527057
SMILES COc1ccc(c(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)c1ccccc1)OC

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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 C29H24N2O5 MW 480.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24N2O5/c1-35-19-13-15-23(36-2)22(16-19)31-28(33)24-21-14-12-17-8-6-7-11-20(17)30(21)26(25(24)29(31)34)27(32)18-9-4-3-5-10-18/h3-16,21,24-26H,1-2H3/t21-,24-,25-,26+/m1/s1
InChIKey
VCSKXKIUBQXGFV-MYCYEZBNSA-N
Synonyms
957015-48-4
(10~(R)11~(S)15~(R)16~(S))16benzoyl13(25dimethoxyphenyl)113diazatetracyclo(8600^(27)0^(1115))hexadeca2468tetraene1214dione
(6aR6bS9aR10S)10benzoyl8(25dimethoxyphenyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
(6aR6bS9aR10S)8(25dimethoxyphenyl)10(phenylcarbonyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
16397768
957015484
COc1ccc(c(c1)N1C(=O)(C@H)2(C@@H)(C1=O)(C@H)(N1(C@@H)2C=Cc2c1cccc2)C(=O)c1ccccc1)OC
InChI=1SC29H24N2O5c13519131523(362)22(1619)3128(33)24211412178671120(17)30(21)26(25(24)29(31)34)27(32)1894351018h316212426H12H3t21242526+m1s1
MFCD02988348
ZINC000008964771
ZINC8964771

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Available files

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