Vitas-M small molecule compound
(2'R,3'R)-3'-(2,2-dimethylpropanoyl)-2'-(4-methoxyphenyl)-2,2-dimethyl-2',3'-dihydro-10b'H-spiro[1,3-dioxane-5,1'-pyrrolo[2,1-a]phthalazine]-4,6-dione
Catalog ID
STK549198
SMILES COc1ccc(cc1)[C@H]1[C@@H](N2C(C31C(=O)OC(OC3=O)(C)C)c1ccccc1C=N2)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 C28H30N2O6 MW 490.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O6/c1-26(2,3)23(31)21-20(16-11-13-18(34-6)14-12-16)28(24(32)35-27(4,5)36-25(28)33)22-19-10-8-7-9-17(19)15-29-30(21)22/h7-15,20-22H,1-6H3/t20-,21+,22?/m0/s1InChIKey
PVHPNKKOQBLKEM-UGGDCYSXSA-NSynonyms
1164562-32-6(2R3R)2(4methoxyphenyl)22dimethyl3pivaloyl310bdihydro2Hspiro((13)dioxane51pyrrolo(21a)phthalazine)46dione
(2R3R)3(22dimethylpropanoyl)2(4methoxyphenyl)22dimethyl23dihydro10bHspiro(13dioxane51pyrrolo(21a)phthalazine)46dione
(2R3R)3(22dimethylpropanoyl)2(4methoxyphenyl)22dimethylspiro(13dioxane51310bdihydro2Hpyrrolo(21a)phthalazine)46dione
1164562326
CC1(OC(=O)C2(C(C(N3C2C4=CC=CC=C4C=N3)C(=O)C(C)(C)C)C5=CC=C(C=C5)OC)C(=O)O1)C
COc1ccc(cc1)(C@H)1(C@@H)(N2C(C31C(=O)OC(OC3=O)(C)C)c1ccccc1C=N2)C(=O)C(C)(C)C
InChI=1SC28H30N2O6c126(23)23(31)2120(16111318(346)141216)28(24(32)3527(45)3625(28)33)22191087917(19)152930(21)22h7152022H16H3t2021+22?m0s1
ZINC000008691747
ZINC000008691748
Check stock
See real-time availability and sample size for STK549198 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.