Andrimid

SpectraBase Compound ID	Fga426XHUqf
InChI	InChI=1S/C27H33N3O5/c1-5-6-7-8-12-15-21(31)28-20(19-13-10-9-11-14-19)16-22(32)29-24(17(2)3)25(33)23-18(4)26(34)30-27(23)35/h5-15,17-18,20,23-24H,16H2,1-4H3,(H,28,31)(H,29,32)(H,30,34,35)/b6-5+,8-7+,15-12+/t18-,20-,23+,24-/m0/s1
InChIKey	OHDXGZAYYBMHCY-QSUIEZAASA-N Google Search
Mol Weight	479.6 g/mol
Molecular Formula	C27H33N3O5
Exact Mass	479.242021 g/mol

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SpectraBase Spectrum ID	4krV3skmNCB
Name	Andrimid
Alternate Name(s)	(2E,4E,6E)-N-[(1S)-3-[[(1S)-1-[(3R,4S)-2,5-diketo-4-methyl-pyrrolidine-3-carbonyl]-2-methyl-propyl]amino]-3-keto-1-phenyl-propyl]octa-2,4,6-trienamide (2E,4E,6E)-N-[(1S)-3-[[(1S)-2-methyl-1-[(3R,4S)-4-methyl-2,5-dioxo-pyrrolidine-3-carbonyl]propyl]amino]-3-oxo-1-phenyl-propyl]octa-2,4,6-trienamide (2E,4E,6E)-N-[(1S)-3-[[(2S)-3-methyl-1-[(3R,4S)-4-methyl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-1-oxidanylidene-butan-2-yl]amino]-3-oxidanylidene-1-phenyl-propyl]octa-2,4,6-trienamide (2E,4E,6E)-N-[(1S)-3-[[(2S)-3-methyl-1-[(3R,4S)-4-methyl-2,5-dioxo-3-pyrrolidinyl]-1-oxobutan-2-yl]amino]-3-oxo-1-phenylpropyl]octa-2,4,6-trienamide (2E,4E,6E)-N-[(1S)-3-[[(2S)-3-methyl-1-[(3R,4S)-4-methyl-2,5-dioxopyrrolidin-3-yl]-1-oxobutan-2-yl]amino]-3-oxo-1-phenylpropyl]octa-2,4,6-trienamide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H33N3O5
InChI	InChI=1S/C27H33N3O5/c1-5-6-7-8-12-15-21(31)28-20(19-13-10-9-11-14-19)16-22(32)29-24(17(2)3)25(33)23-18(4)26(34)30-27(23)35/h5-15,17-18,20,23-24H,16H2,1-4H3,(H,28,31)(H,29,32)(H,30,34,35)/b6-5+,8-7+,15-12+/t18-,20-,23+,24-/m0/s1
InChIKey	OHDXGZAYYBMHCY-QSUIEZAASA-N
Molecular Weight	479.577 g/mol
SMILES	N1C([C@]([C@](C([C@@](NC(C[C@](NC(\C=C\C=C\C=C\C)=O)(c2ccccc2)[H])=O)(C(C)C)[H])=O)(C1=O)[H])(C)[H])=O
SPLASH	splash10-00xs-0940000000-49fc61274fd07b71f93d
Source of Spectrum	J-59-2062-1
Wiley ID	1395033