Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Info

InChI	InChI=1S/C76H50N4O8/c1-85-63-39-27-43-11-3-7-15-51(43)69(63)71-53-17-9-5-13-45(53)29-41-65(71)87-73-59-35-31-55(77-59)67(47-19-23-49(24-20-47)75(81)82)57-33-37-61(79-57)74(62-38-34-58(80-62)68(56-32-36-60(73)78-56)48-21-25-50(26-22-48)76(83)84)88-66-42-30-46-14-6-10-18-54(46)72(66)70-52-16-8-4-12-44(52)28-40-64(70)86-2/h3-42,77,80H,1-2H3,(H,81,82)(H,83,84)/b67-55-,67-57-,68-56-,68-58-,73-59+,73-60+,74-61+,74-62+
SMILES	COc1ccc2c(c1c1c(ccc3c1cccc3)O/C/1=C/3\C=CC(=N3)/C(=c\3/cc/c(=C(/C4=N/C(=C(\c5[nH]c1cc5)/c1ccc(cc1)C(=O)O)/C=C4)\Oc1ccc4c(c1c1c(OC)ccc5c1cccc5)cccc4)/[nH]3)/c1ccc(cc1)C(=O)O)cccc2
InChI Key	UAYOEZBMWJYGBX-BWQJBSMHSA-N
Molecular Formula	C76H50N4O8
Exact Mass	1147.232 g/mol

Data and Resources

• 1H nuclear magnetic resonance spectroscopy (1H NMR)HTML
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Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/UAYOEZBMWJYGBX-BWQJBSMHSA-N/CHMO0000593
License URL
Source	https://www.chemotion-repository.net/inchikey/UAYOEZBMWJYGBX-BWQJBSMHSA-N/CHMO0000593
Version
Author	Lukas Langer
Maintainer	Chemotion Repository
Language	english
MetadataCreated	2024-09-07T06:44:23.343327
MetadataModified	2024-09-07T22:18:31.192938
MetadataPublished	2022-05-16
Related Molecule

Field	Value
Measurement Technique	1H nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
No additional information available for this Dataset.