| SpectraBase Spectrum ID |
FyF2DdtTg4B |
| Name |
Clarithromycin-M (N-demethyl-) MS3_1 |
| Comments |
F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [145.00-590.00] |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C29H54NO10 |
| InChI |
InChI=1S/C29H53NO10/c1-11-20-29(8,36)24(34)16(4)21(31)14(2)13-28(7,37-10)25(17(5)22(32)18(6)26(35)39-20)40-27-23(33)19(30-9)12-15(3)38-27/h14-20,22-25,27,30,32-34,36H,11-13H2,1-10H3/p+1 |
| InChIKey |
FVDOVQNVEPKVLO-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
OC1C(OC2C(CC(C(C(C(C(C(OC(C(C(C2C)O)C)=O)CC)(O)C)O)C)=O)C)(OC)C)OC(CC1[NH2+]C)C |
| Sample Comments |
The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database. |
| Sample Description |
Analyte Type: Metabolite |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms3 |
| Technique |
ITMS |
