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9,12:25,28-Dietheno-5H,21H-dipyrrolo[1,2-e:1',2'-s][1,15,5,8,19,22]dioxatetraazacyclooctacosine-5,16,21,32(13H,29H)-tetrone, 1,2,3,6,7,14,15,16a,17,18,19,22,23,30,31,32a-hexadecahydro-, [16aS-(16aR*,32aR*)]-
SpectraBase Compound ID AVFmrpfBfHZ
InChI InChI=1S/C32H40N4O6/c37-29-15-21-41-25-9-7-24(8-10-25)14-18-34-32(40)28-4-2-20-36(28)30(38)16-22-42-26-11-5-23(6-12-26)13-17-33-31(39)27-3-1-19-35(27)29/h5-12,27-28H,1-4,13-22H2,(H,33,39)(H,34,40)
InChIKey FPYKBUYTKKPIDX-UHFFFAOYSA-N
Mol Weight 576.7 g/mol
Molecular Formula C32H40N4O6
Exact Mass 576.294785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10j6FFQGS37
Name 9,12:25,28-Dietheno-5H,21H-dipyrrolo[1,2-e:1',2'-s][1,15,5,8,19,22]dioxatetraazacyclooctacosine-5,16,21,32(13H,29H)-tetrone, 1,2,3,6,7,14,15,16a,17,18,19,22,23,30,31,32a-hexadecahydro-, [16aS-(16aR*,32aR*)]-
Alternate Name(s) 2,19-dioxa-6,12,23,29-tetraazapentacyclo[30.2.2.2(15,18).0(6,10).0(23,27)]octatriaconta-1(34),15,17,32,35,37-hexaene-5,11,22,28-tetrone Cyclo-(3-(4-.beta.-aminoethyl)phenyloxypropanoyl-L-prolyl)2
CAS Registry Number 68898-96-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H40N4O6
InChI InChI=1S/C32H40N4O6/c37-29-15-21-41-25-9-7-24(8-10-25)14-18-34-32(40)28-4-2-20-36(28)30(38)16-22-42-26-11-5-23(6-12-26)13-17-33-31(39)27-3-1-19-35(27)29/h5-12,27-28H,1-4,13-22H2,(H,33,39)(H,34,40)
InChIKey FPYKBUYTKKPIDX-UHFFFAOYSA-N
Molecular Weight 576.694 g/mol
SMILES N1CCc2ccc(OCCC(N3C(C(NCCc4ccc(OCCC(N5CCCC5C1=O)=O)cc4)=O)CCC3)=O)cc2
SPLASH splash10-00di-9000000000-262d851a07f26864c9b8
Source of Spectrum C-100-8209-0
Wiley ID 1408219