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(2R,8R)-2-[[(2S)-4-tert-butoxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-keto-butanoyl]amino]-3-keto-pyrrolizidine-8-carboxylic acid

View entire compound with spectra: 1 MS (GC)

(2R,8R)-2-[[(2S)-4-tert-butoxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-keto-butanoyl]amino]-3-keto-pyrrolizidine-8-carboxylic acid
SpectraBase Compound ID 8Mxi5J9KFsm
InChI InChI=1S/C31H35N3O8/c1-30(2,3)42-25(35)15-23(26(36)32-24-16-31(28(38)39)13-8-14-34(31)27(24)37)33-29(40)41-17-22-20-11-6-4-9-18(20)19-10-5-7-12-21(19)22/h4-7,9-12,22-24H,8,13-17H2,1-3H3,(H,32,36)(H,33,40)(H,38,39)/t23-,24+,31+/m0/s1
InChIKey MRRLGBSLAOYWNP-BKZGZDJESA-N
Mol Weight 577.6 g/mol
Molecular Formula C31H35N3O8
Exact Mass 577.242415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6nJ8JsQXQmS
Name (2R,8R)-2-[[(2S)-4-tert-butoxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-keto-butanoyl]amino]-3-keto-pyrrolizidine-8-carboxylic acid
Alternate Name(s) (6R,8R)-6-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-butanoyl]amino]-5-oxidanylidene-2,3,6,7-tetrahydro-1H-pyrrolizine-8-carboxylic acid (6R,8R)-6-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoyl]amino]-5-oxo-2,3,6,7-tetrahydro-1H-pyrrolizine-8-carboxylic acid (6R,8R)-6-[[(2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-[(2-methylpropan-2-yl)oxy]-1,4-dioxobutyl]amino]-5-oxo-2,3,6,7-tetrahydro-1H-pyrrolizine-8-carboxylic acid (6R,8R)-6-[[(2S)-4-tert-butoxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-oxo-butanoyl]amino]-5-oxo-2,3,6,7-tetrahydro-1H-pyrrolizine-8-carboxylic acid
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Formula C31H35N3O8
InChI InChI=1S/C31H35N3O8/c1-30(2,3)42-25(35)15-23(26(36)32-24-16-31(28(38)39)13-8-14-34(31)27(24)37)33-29(40)41-17-22-20-11-6-4-9-18(20)19-10-5-7-12-21(19)22/h4-7,9-12,22-24H,8,13-17H2,1-3H3,(H,32,36)(H,33,40)(H,38,39)/t23-,24+,31+/m0/s1
InChIKey MRRLGBSLAOYWNP-BKZGZDJESA-N
Molecular Weight 577.634 g/mol
SMILES N([C@]1(C(N2[C@](C(=O)O)(CCC2)C1)=O)[H])C([C@](CC(=O)OC(C)(C)C)(NC(=O)OCC1c2ccccc2-c2ccccc12)[H])=O
SPLASH splash10-004i-2900000000-ea973e7cf51a44de70aa
Source of Spectrum F-70-864-25
Wiley ID 1596140