Go to resource

mass spectrometry (MS)

URL: https://www.chemotion-repository.net/inchikey/OZJSFXFQYYVXCC-LLVUNYEQSA-N/CHMO0000470

Dataset description:

dataset for mass spectrometry (MS)\n\n

Source: mass spectrometry (MS)

Chemical Info

molecular Image

InChI	InChI=1S/C62H74N10O8/c1-3-5-25-49-57(75)67-51(33-43-35-63-47-27-15-13-23-45(43)47)61(79)69(37-41-19-9-7-10-20-41)40-56(74)72-32-18-30-54(72)60(78)66-50(26-6-4-2)58(76)68-52(34-44-36-64-48-28-16-14-24-46(44)48)62(80)70(38-42-21-11-8-12-22-42)39-55(73)71-31-17-29-53(71)59(77)65-49/h7-16,19-24,27-28,35-36,49-54,63-64H,3-6,17-18,25-26,29-34,37-40H2,1-2H3,(H,65,77)(H,66,78)(H,67,75)(H,68,76)/t49-,50-,51-,52-,53+,54+/m0/s1
SMILES	CCCC[C@@H]1NC(=O)[C@H]2CCCN2C(=O)CN(Cc2ccccc2)C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]2N(C(=O)CN(C(=O)[C@@H](NC1=O)Cc1c[nH]c3c1cccc3)Cc1ccccc1)CCC2)CCCC)Cc1c[nH]c2c1cccc2
InChI Key	OZJSFXFQYYVXCC-LLVUNYEQSA-N
Molecular Formula	C62H74N10O8
Exact Mass	1087.313 g/mol

There are no views created for this resource yet.

Additional Information

Field	Value
Data last updated	September 7, 2024
Metadata last updated	September 7, 2024
Created	September 7, 2024
Format	HTML
License	No License Provided
Id	78e693ed-6669-44a4-a14f-21040a2e1bda
Package id	10-14272-ozjsfxfqyyvxcc-llvunyeqsa-n-chmo0000470
Resource type	HTML
State	active