Q105133742

chemical compound

Wikidata entity: Q105133742

C₄₃H₅₈N₄O₁₂ (P274)

Quantities

P2067mass822.405123296

P233 canonical SMILES String COC1C=COC2(C)Oc3c(C)c(O)c4c(O)c(c(C=NN5CCN(C)CC5)c(O)c4c3C2=O)NC(=O)C(C)=CC=CC(C)C(O)C(C)C(O)C(C)C(OC(C)=O)C1C ???
P703 found in taxon ... Q25419 (Escherichia coli) Escherichia coli
P703 found in taxon ... Q3975996 (Streptomyces hygroscopicus) Streptomyces hygroscopicus
P31 instance of ... Q113145171 (type of chemical entity) type of chemical entity
P2017 isomeric SMILES String CO[C@H]1/C=C/O[C@@]2(C)Oc3c(C)c(O)c4c(O)c(c(/C=N/N5CCN(C)CC5)c(O)c4c3C2=O)NC(=O)C(C)=CC=C[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C ???
P3364 stereoisomer of ... Q422652 (rifampicin) rifampicin
P279 subclass of ... Q109393859 (piperazine alkaloid) piperazine alkaloid
External Ids
P234InChIInChI=1S/C43H58N4O12/c1-21-12-11-13-22(2)42(55)45-33-28(20-44-47-17-15-46(9)16-18-47)37(52)30-31(38(33)53)36(51)26(6)40-32(30)41(54)43(8,59-40)57-19-14-29(56-10)23(3)39(58-27(7)48)25(5)35(50)24(4)34(21)49/h11-14,19-21,23-25,29,34-35,39,49-53H,15-18H2,1-10H3,(H,45,55)/b12-11?,19-14+,22-13?,44-20+/t21-,23+,24+,25+,29-,34-,35+,39+,43-/m0/s1
P235InChIKeyJQXXHWHPUNPDRT-MJJHYSHBSA-N
P662PubChem CID172916695

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