| SpectraBase Spectrum ID |
GYRm9u68WsC |
| Name |
Tetracycline |
| CAS Registry Number |
60-54-8 |
| Classification |
Pharmaceutical drug, antibiotic |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
444.153265733 u |
| Formula |
C22H24N2O8 |
| InChI |
InChI=1S/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25,27-28,31-32H,7H2,1-3H3,(H2,23,30)/t9?,10?,15-,21+,22-/m0/s1 |
| InChIKey |
OFVLGDICTFRJMM-DXMYQVORSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
444.440 g/mol |
| Nominal Mass |
444 u |
| Quality |
936 |
| SMILES |
NC(C1=C([C@](C2[C@](C(=C3C([C@@](C=4C(C3=O)=C(C=CC4)O)(O)C)C2)O)(C1=O)O)(N(C)C)[H])O)=O |
| SPLASH |
splash10-0a59-9744300000-3b2ad9b0e9ff739113d6 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Achromycin
(4S,4aS,5aS,12aS)-2-(Amino-hydroxy-methylidene)-4-dimethylamino-6,10,11,12a-tetrahydroxy-\r6-methyl-4,4a,5,5a-tetrahydrotetracene-1,3,12-trione |
| Technique |
DI/MS |
| Wiley ID |
DD2024_003997 |
