Cirramycin A1
Compound with spectra: 1 NMR
| SpectraBase Compound ID | 5R9cHmybboP |
|---|---|
| InChI | InChI=1S/C31H51NO10/c1-9-23-18(4)29-31(6,42-29)12-10-21(34)16(2)14-20(11-13-33)28(17(3)22(35)15-24(36)40-23)41-30-27(38)25(32(7)8)26(37)19(5)39-30/h10,12-13,16-20,22-23,25-30,35,37-38H,9,11,14-15H2,1-8H3/b12-10+/t16?,17?,18?,19-,20?,22?,23?,25+,26+,27-,28?,29?,30+,31?/m0/s1 |
| InChIKey | PYLRKBRNWXMGSG-LZWNZAKUSA-N |
| Mol Weight | 597.7 g/mol |
| Molecular Formula | C31H51NO10 |
| Exact Mass | 597.351297 g/mol |
| Enantiomer InChIKey | PYLRKBRNWXMGSG-QBGYEBSTSA-N |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
(14E)-9-(4-dimethylamino-3-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-3-ethyl-7-hydroxy-10-[(E)-4-ketopent-2-enyl]-2,8,12,16-tetramethyl-4,17-dioxabicyclo[14.1.0]heptadec-14-ene-5,13-quinone
6108-D
6108-A1;MAJOR
2-[(14E)-9-(4-dimethylamino-3-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-3-ethyl-7-hydroxy-5,13-diketo-2,8,12,16-tetramethyl-4,17-dioxabicyclo[14.1.0]heptadec-14-en-10-yl]acetic acid
6108-B
6108-C
FIKKAXKYMNJIBE-VAWYXSNFSA-N
XQGGUPWPBXHLPC-OUKQBFOZSA-N
4-Hydroxy-6-(2-methyl-4-dimethylamino-5-hydroxy-1-oxacyclohexyloxy)-7-(formylmethyl)-16-ethyl-5,9,13,15-tetramethyl-13,14-epoxy-1-oxacyclohexadeca-11-en-2,10-dione
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.