Vitas-M small molecule compound
(8S,8aR,11aS)-8-[(4-nitrophenyl)carbonyl]-10-[(1R)-1-phenylethyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STL051925
SMILES O=C([C@@H]1[C@H]2[C@@H](C3N1C=Cc1c3cccc1)C(=O)N(C2=O)[C@@H](c1ccccc1)C)c1ccc(cc1)[N+](=O)[O-]
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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 C29H23N3O5 MW 493.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N3O5/c1-17(18-7-3-2-4-8-18)31-28(34)23-24(29(31)35)26(27(33)20-11-13-21(14-12-20)32(36)37)30-16-15-19-9-5-6-10-22(19)25(23)30/h2-17,23-26H,1H3/t17-,23+,24-,25?,26+/m1/s1InChIKey
BQRZUJOAIBJIQW-KFWXSRPBSA-NSynonyms
1013885-56-7(8S8aR11aS)8((4nitrophenyl)carbonyl)10((1R)1phenylethyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS)8(4nitrobenzoyl)10((R)1phenylethyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
1013885567
CC(C1=CC=CC=C1)N2C(=O)C3C(C2=O)C(N4C3C5=CC=CC=C5C=C4)C(=O)C6=CC=C(C=C6)(N+)(=O)(O)
InChI=1SC29H23N3O5c117(187324818)3128(34)2324(29(31)35)26(27(33)20111321(141220)32(36)37)301615199561022(19)25(23)30h2172326H1H3t1723+2425?26+m1s1
MFCD18249429
O=C((C@@H)1(C@H)2(C@@H)(C3N1C=Cc1c3cccc1)C(=O)N(C2=O)(C@@H)(c1ccccc1)C)c1ccc(cc1)(N+)(=O)(O)
ZINC000035844199
ZINC000101215041
Check stock
See real-time availability and sample size for STL051925 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.