Vitas-M small molecule compound
(E)-{1-[2-(diethylammonio)ethyl]-2-(4-hydroxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate
Catalog ID
STL042332
SMILES CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)CC[NH+](CC)CC)/[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 C26H32N2O5 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N2O5/c1-4-17-33-21-13-9-19(10-14-21)24(30)22-23(18-7-11-20(29)12-8-18)28(26(32)25(22)31)16-15-27(5-2)6-3/h7-14,23,29-30H,4-6,15-17H2,1-3H3/b24-22+InChIKey
PGHPQZFMOFFKMI-ZNTNEXAZSA-NSynonyms
848870-51-9(4E)1(2DIETHYLAMINOETHYL)5(4HYDROXYPHENYL)4(HYDROXY(4PROPOXYPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)2(4hydroxyphenyl)45dioxopyrrolidin3ylidene)(4propoxyphenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)2(4HYDROXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4PROPOXYPHENYL)METHANOLATE
848870519
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC(NH+)(CC)CC)C3=CC=C(C=C3)O)(O)
CCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)O)CC(NH+)(CC)CC)(O)
InChI=1SC26H32N2O5c1417332113919(101421)24(30)2223(1871120(29)12818)28(26(32)25(22)31)161527(52)63h714232930H461517H213H3b2422+
MFCD18248154
ZINC000102869861
ZINC000102869864
Check stock
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Check stock on Vitas-MAvailable files
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