Vitas-M small molecule compound

(8S,8aR,11aS)-10-(2,4-dimethylphenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione

Catalog ID
STK547833
SMILES COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3

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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 C30H26N2O4 MW 478.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N2O4/c1-17-8-13-23(18(2)16-17)32-29(34)24-25(30(32)35)27(28(33)20-9-11-21(36-3)12-10-20)31-15-14-19-6-4-5-7-22(19)26(24)31/h4-16,24-27H,1-3H3/t24-,25+,26?,27-/m0/s1
InChIKey
ITQOPOLAKKJTNE-UEEAVMEZSA-N
Synonyms
1014061-02-9
(8S8aR11aS)10(24dimethylphenyl)8((4methoxyphenyl)carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS)10(24dimethylphenyl)8(4methoxybenzoyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
1014061029
CC1=CC(=C(C=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)C6=CC=C(C=C6)OC)C
COc1ccc(cc1)C(=O)(C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc(cc1C)C)cccc3
InChI=1SC30H26N2O4c11781323(18(2)1617)3229(34)2425(30(32)35)27(28(33)2091121(363)121020)31151419645722(19)26(24)31h4162427H13H3t2425+26?27m0s1
MFCD18242374
ZINC000016037807
ZINC000034257589

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Available files

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