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N-Desmethyl Clarithromycin

URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU202003

Dataset description:

This MassBank record with Accession MSBNK-Athens_Univ-AU202003 contains the MS2 mass spectrum of N-Desmethyl Clarithromycin with the InChIkey CIJTVUQEURKBDL-UHFFFAOYSA-N.

Source: N-Desmethyl Clarithromycin

Chemical Info

molecular Image

InChI	InChI=1S/C37H67NO13/c1-14-25-37(10,44)30(41)20(4)27(39)18(2)16-36(9,46-13)32(51-34-28(40)24(38-11)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-35(8,45-12)31(42)23(7)48-26/h18-26,28-32,34,38,40-42,44H,14-17H2,1-13H3
SMILES	CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(NC)C2O)C(C)(CC(C)C(=O)C(C)C(O)C1(C)O)OC
InChI Key	CIJTVUQEURKBDL-UHFFFAOYSA-N
Molecular Formula	C37H67NO13
Exact Mass	733.461 g/mol

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Additional Information

Field	Value
Data last updated	January 11, 2024
Metadata last updated	January 11, 2024
Created	January 11, 2024
Format	HTML
License	Attribution-ShareAlike 4.0 International (CC BY-SA 4.0)
Id	4accac17-6715-40ea-a4a1-2f0c6c761dff
Package id	msbnk-athens_univ-au202003
Resource type	HTML
State	active