Vitas-M small molecule compound

2,6-bis(2-hydroxyethyl)hexahydro-4,8-ethenopyrrolo[3,4-f]isoindole-1,3,5,7(2H,6H)-tetrone

Catalog ID
STK825641
SMILES OCCN1C(=O)C2C(C1=O)C1C=CC2C2C1C(=O)N(C2=O)CCO

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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 C16H18N2O6 MW 334.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O6/c19-5-3-17-13(21)9-7-1-2-8(11(9)15(17)23)12-10(7)14(22)18(4-6-20)16(12)24/h1-2,7-12,19-20H,3-6H2
InChIKey
IYRBGBHQRCADLS-UHFFFAOYSA-N
Synonyms

(3aR4R8S8aS)26bis(2hydroxyethyl)44a88atetrahydro48ethenopyrrolo(34f)isoindole1357(2H3aH6H7aH)tetraone
26bis(2hydroxyethyl)hexahydro48ethenopyrrolo(34f)isoindole1357(2H6H)tetrone
C1=CC2C3C(C1C4C2C(=O)N(C4=O)CCO)C(=O)N(C3=O)CCO
InChI=1SC16H18N2O6c19531713(21)97128(11(9)15(17)23)1210(7)14(22)18(4620)16(12)24h127121920H36H2
MFCD02197777
OCCN1C(=O)C2(C@@H)(C1=O)C1C=CC2C2(C@@H)1C(=O)N(C2=O)CCO
ZINC000169302740
ZINC000239321955

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Available files

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