4-epioxytetracycline (Q27266209)

4-Epioxytetracycline (English)

14 October 2016

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₂H₂₄N₂O₉

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC1(C2=CC=CC(=C2C(=O)C3=C(C4(C(C(C31)O)C(C(=C(C4=O)C(=O)N)O)N(C)C)O)O)O)O

1 reference

4-epioxytetracycline (English)

14 October 2016

isomeric SMILES

C[C@]1(C2=CC=CC(=C2C(=O)C3=C([C@]4([C@@H]([C@H]([C@@H]31)O)[C@H](C(=C(C4=O)C(=O)N)O)N(C)C)O)O)O)O

1 reference

4-epioxytetracycline (English)

InChI=1S/C22H24N2O9/c1-21(32)7-5-4-6-8(25)9(7)15(26)10-12(21)17(28)13-14(24(2)3)16(27)11(20(23)31)19(30)22(13,33)18(10)29/h4-6,12-14,17,25,27-29,32-33H,1-3H3,(H2,23,31)/t12-,13-,14-,17+,21-,22+/m1/s1

14 October 2016

Identifiers

InChI

1 reference

4-epioxytetracycline (English)

IWVCMVBTMGNXQD-DVJPNYBFSA-N

14 October 2016

InChIKey

1 reference

4-epioxytetracycline (English)

14 October 2016

2 references

https://commonchemistry.cas.org/detail?cas_rn=14206-58-7

4-epioxytetracycline (English)

14 October 2016

6 April 2021

InChIKey

IWVCMVBTMGNXQD-DVJPNYBFSA-N

1 reference

4-Epioxytetracycline (English)

DSSTOX compound identifier

14 October 2016

DSSTox substance ID

DTXSID20873793

0 references

0 references

2 references

4-epioxytetracycline (English)