CHEBI:75258 - penimepicycline

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ChEBI Name penimepicycline
ChEBI ID CHEBI:75258
Definition A penicillinate salt obtained by combining equimolar amounts of phenoxymethylpenicillin and pipacycline.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formulae C29H38N4O9.C16H18N2O5S
C45H56N6O14S
Net Charge 0
Average Mass 937.02300
Monoisotopic Mass 936.358
InChI InChI=1S/C29H38N4O9.C16H18N2O5S/c1-28(41)15-5-4-6-18(35)19(15)23(36)20-16(28)13-17-22(31(2)3)24(37)21(26(39)29(17,42)25(20)38)27(40)30-14-33-9-7-32(8-10-33)11-12-34;1-16(2)12(15(21)22)18-13(20)11(14(18)24-16)17-10(19)8-23-9-6-4-3-5-7-9/h4-6,16-17,22,34-35,37-38,41-42H,7-14H2,1-3H3,(H,30,40);3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/t16-,17-,22-,28+,29-;11-,12+,14-/m01/s1
InChIKey MEGKRPMNPGTIIG-VNYBMUHKSA-N
SMILES [H][C@]12SC(C)(C)[C@@H](N1C(=O)[C@H]2NC(=O)COc1ccccc1)C(O)=O.[H][C@@]12C[C@@]3([H])C(C(=O)c4c(O)cccc4[C@@]3(C)O)=C(O)[C@]1(O)C(=O)C(C(=O)NCN1CCN(CCO)CC1)=C(O)[C@H]2N(C)C
Roles Classification
Biological Role(s): antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing penimepicycline (CHEBI:75258) has part phenoxymethylpenicillin(1−) (CHEBI:51355)
penimepicycline (CHEBI:75258) has part pipacycline(1+) (CHEBI:75267)
penimepicycline (CHEBI:75258) has role antimicrobial agent (CHEBI:33281)
penimepicycline (CHEBI:75258) is a penicillinate salt (CHEBI:75260)
INNs Sources
penimepiciclina WHO MedNet
pénimépicycline WHO MedNet
penimepicycline KEGG DRUG
penimepicyclinum ChemIDplus
Synonyms Sources
Hydrocycline ChemIDplus
Mepicycline penicillinate ChemIDplus
Penetracyne ChemIDplus
Penimepiciclina ChemIDplus
pipacycline-penicillin V ChEBI
pipacycline/penicillin V ChEBI
Manual Xrefs Databases
D07233 KEGG DRUG
EA012203 Patent
GB891004 Patent
GB897826 Patent
US5637579 Patent
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Registry Numbers Types Sources
4599-60-4 CAS Registry Number KEGG DRUG
4599-60-4 CAS Registry Number ChemIDplus
4921287 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
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Last Modified
07 September 2013