Vitas-M small molecule compound
4-(5-benzyl-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl)-2-methoxyphenyl benzoate
Catalog ID
STL006123
SMILES COc1cc(ccc1OC(=O)c1ccccc1)C1C2C(=O)N(C(=O)C2ON1c1ccccc1)Cc1ccccc1
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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 C32H26N2O6 MW 534.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H26N2O6/c1-38-26-19-23(17-18-25(26)39-32(37)22-13-7-3-8-14-22)28-27-29(40-34(28)24-15-9-4-10-16-24)31(36)33(30(27)35)20-21-11-5-2-6-12-21/h2-19,27-29H,20H2,1H3InChIKey
PXHSXXUPXFGWPL-UHFFFAOYSA-NSynonyms
1024213-32-8(4(5BENZYL46DIOXO2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)2METHOXYPHENYL)BENZOATE
1024213328
4(5benzyl46dioxo2phenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)2methoxyphenylbenzoate
4(5benzyl46dioxo2phenylhexahydro2Hpyrrolo(34d)isoxazol3yl)2methoxyphenylbenzoate
COC1=C(C=CC(=C1)C2C3C(C(=O)N(C3=O)CC4=CC=CC=C4)ON2C5=CC=CC=C5)OC(=O)C6=CC=CC=C6
InChI=1SC32H26N2O6c138261923(171825(26)3932(37)22137381422)282729(4034(28)241594101624)31(36)33(30(27)35)2021115261221h2192729H20H21H3
MFCD04183391
ZINC000097954641
ZINC000102752790
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