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(8S,10R)-11-Benzyl-14-((R)-tert-butoxycarbonylamino)-5,18-dimethoxy-4-methyl-10,13-dioxo-2-oxa-9,12-diaza-tricyclo[13.3.1.1*3,7*]icosa-1(18),3,5,7(20),15(19),16-hexaene-8-carboxylic acid methyl ester
SpectraBase Compound ID 5VQnj9vEkaS
InChI InChI=1S/C34H39N3O9/c1-19-25(43-6)17-22-18-26(19)45-27-16-21(13-14-24(27)42-5)28(37-33(41)46-34(2,3)4)31(39)35-23(15-20-11-9-8-10-12-20)30(38)36-29(22)32(40)44-7/h8-14,16-18,23,28-29H,15H2,1-7H3,(H,35,39)(H,36,38)(H,37,41)/t23-,28-,29+/m1/s1
InChIKey DWYJZNKXGPITIO-ZPJFYFFZSA-N
Mol Weight 633.7 g/mol
Molecular Formula C34H39N3O9
Exact Mass 633.26863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CABPYdRUcEA
Name (8S,10R)-11-Benzyl-14-((R)-tert-butoxycarbonylamino)-5,18-dimethoxy-4-methyl-10,13-dioxo-2-oxa-9,12-diaza-tricyclo[13.3.1.1*3,7*]icosa-1(18),3,5,7(20),15(19),16-hexaene-8-carboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H39N3O9
InChI InChI=1S/C34H39N3O9/c1-19-25(43-6)17-22-18-26(19)45-27-16-21(13-14-24(27)42-5)28(37-33(41)46-34(2,3)4)31(39)35-23(15-20-11-9-8-10-12-20)30(38)36-29(22)32(40)44-7/h8-14,16-18,23,28-29H,15H2,1-7H3,(H,35,39)(H,36,38)(H,37,41)/t23-,28-,29+/m1/s1
InChIKey DWYJZNKXGPITIO-ZPJFYFFZSA-N
Molecular Weight 633.698 g/mol
SMILES N1[C@@](c2cc(Oc3cc([C@](C(N[C@@](C1=O)(Cc1ccccc1)[H])=O)(NC(OC(C)(C)C)=O)[H])ccc3OC)c(c(c2)OC)C)(C(=O)OC)[H]
SPLASH splash10-00gl-0005690000-e1f4121045d392683fc9
Source of Spectrum J-59-2322-21
Wiley ID 1412247