8,11,14,17,20,33,36,39,42,45-Decaoxa-51,52,53,54-tetraazapentacyclo[45.3.1.12,6.122,26.127,31]tetrapentaconta-1(51),2,4,6(54),22,24,26(53),27,29,31(52),47,49-dodecaene

SpectraBase Compound ID	383K9lTxPqa
InChI	InChI=1S/C40H52N4O10/c1-5-33-29-51-25-21-47-17-13-45-14-19-49-23-27-53-31-35-7-3-11-39(43-35)40-12-4-8-36(44-40)32-54-28-24-50-20-16-46-15-18-48-22-26-52-30-34-6-2-10-38(42-34)37(9-1)41-33/h1-12H,13-32H2
InChIKey	PMUAEWBQWRGXGM-UHFFFAOYSA-N Google Search
Mol Weight	748.9 g/mol
Molecular Formula	C40H52N4O10
Exact Mass	748.368344 g/mol

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SpectraBase Spectrum ID	2JkgIqXVTzy
Name	8,11,14,17,20,33,36,39,42,45-Decaoxa-51,52,53,54-tetraazapentacyclo[45.3.1.12,6.122,26.127,31]tetrapentaconta-1(51),2,4,6(54),22,24,26(53),27,29,31(52),47,49-dodecaene
CAS Registry Number	123074-64-6
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C40H52N4O10
InChI	InChI=1S/C40H52N4O10/c1-5-33-29-51-25-21-47-17-13-45-14-19-49-23-27-53-31-35-7-3-11-39(43-35)40-12-4-8-36(44-40)32-54-28-24-50-20-16-46-15-18-48-22-26-52-30-34-6-2-10-38(42-34)37(9-1)41-33/h1-12H,13-32H2
InChIKey	PMUAEWBQWRGXGM-UHFFFAOYSA-N
Molecular Weight	748.874 g/mol
SMILES	c1-2nc(COCCOCCOCCOCCOCc3nc(-c4cccc(COCCOCCOCCOCCOCc5nc2ccc5)n4)ccc3)ccc1
SPLASH	splash10-000t-0900000000-51bcfe1dc02116b07b2c
Source of Spectrum	J-54-5109-7
Synonyms	8,11,14,17,20,33,36,39,42,45-decaoxa-51,52,53,54-tetraazapentacyclo[45.3.1.1(2,6).1(22,26).1(27,31)]tetrapentaconta-1(51),2(54),3,5,22(53),23,25,27(52),28,30,47,49-dodecaene 8,11,14,17,20,33,36,39,42,45-Decaoxa-51,52,53,54-tetraazapentacyclo[45.3.1.1(2,6).1(22,26)1.(27,31)]tetrapentaconta-1(51),2,4,6(52),22,24,26(53),27,29,31(54),47,49-dodecaene
Wiley ID	1416289