Vitas-M small molecule compound
(2'R,3'R)-3'-acetyl-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
STK556837
SMILES COc1ccc(cc1)[C@H]1[C@H](C(=O)C)N2C(C31C(=O)OC(OC3=O)(C)C)c1ccccc1C=N2
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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 C25H24N2O6 MW 448.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O6/c1-14(28)20-19(15-9-11-17(31-4)12-10-15)25(22(29)32-24(2,3)33-23(25)30)21-18-8-6-5-7-16(18)13-26-27(20)21/h5-13,19-21H,1-4H3/t19-,20-,21?/m0/s1InChIKey
JVYQRNQDQHCNHS-AHTKWCMKSA-NSynonyms
1164468-29-4(2R3R)3acetyl2(4methoxyphenyl)22dimethyl23dihydro10bHspiro(13dioxane51pyrrolo(21a)phthalazine)46dione
(2R3R)3acetyl2(4methoxyphenyl)22dimethyl310bdihydro2Hspiro((13)dioxane51pyrrolo(21a)phthalazine)46dione
(2R3R)3acetyl2(4methoxyphenyl)22dimethylspiro(13dioxane51310bdihydro2Hpyrrolo(21a)phthalazine)46dione
1164468294
CC(=O)C1C(C2(C3N1N=CC4=CC=CC=C34)C(=O)OC(OC2=O)(C)C)C5=CC=C(C=C5)OC
COc1ccc(cc1)(C@H)1(C@H)(C(=O)C)N2C(C31C(=O)OC(OC3=O)(C)C)c1ccccc1C=N2
InChI=1SC25H24N2O6c114(28)2019(1591117(314)121015)25(22(29)3224(23)3323(25)30)2118865716(18)132627(20)21h5131921H14H3t192021?m0s1
ZINC000008691605
ZINC000008691606
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