Compound ID | 3173

Update compound information

Kijanimicin

Synonym(s): Sch 25663

Class: Natural product antibiotic

Spectrum of activity: Gram-positive
Details of activity: Active against Propionibacterium acnes
Description: Natural product from Actinomadura kijaniata; spirotetronate; shows activity against Plasmodium including in vivo
Institute where first reported: Schering Corporation
Year first mentioned: 1981
Development status: Experimental
Chemical structure(s):
Click here for structure editor
Molecular weight: 1317.51
Iso. SMILES: C[C@H]1C[C@@H]([C@@H]([C@@H]2[C@@H]1[C@]\3([C@@H](C=C2)/C(=C\C[C@@H](/C(=C/[C@@H]4C=C([C@@H](CC45C(=O)/C(=C3\O)/C(=O)O5)C)CO)/C)O[C@H]6C[C@]([C@H]([C@H](O6)C)NC(=O)OC)(C)[N+](=O)[O-])/C)C)O[C@H]7C[C@H]([C@H]([C@@H](O7)C)O)O[C@H]8C[C@H]([C@H]([C@@H](O8)C)O[C@@H]9C[C@H]([C@H]([C@@H](O9)C)OC)O)O[C@H]1C[C@H]([C@H]([C@@H](O1)C)O)O)C
InChI Key: LKSBZILVASNBPF-WPZATFCYSA-N
Can. SMILES: C/C/1=C/C[C@@H](/C(=C/[C@@H]2C=C(CO)[C@H](C)CC23C(=O)/C(=C(/[C@]4(C)[C@H]1C=C[C@H]5[C@H]4[C@@H](C)C[C@H](C)[C@@H]5O[C@H]6C[C@H]([C@H]([C@H](C)O6)O)O[C@H]7C[C@H]([C@H]([C@H](C)O7)O[C@@H]8C[C@H]([C@H]([C@H](C)O8)OC)O)O[C@H]9C[C@H]([C@H]([C@H](C)O9)O)O)\O)/C(=O)O3)/C)O[C@H]%10C[C@@](C)([C@H]([C@@H](C)O%10)NC(=O)OC)[N+](=O)[O-]
InChI: InChI=1S/C67H100N2O24/c1-29-15-18-45(88-52-27-65(11,69(79)80)60(38(10)87-52)68-64(78)82-14)30(2)20-40-21-39(28-70)33(5)26-67(40)62(76)53(63(77)93-67)61(75)66(12)42(29)17-16-41-54(66)31(3)19-32(4)57(41)91-51-24-46(56(74)35(7)84-51)89-50-25-47(90-48-22-43(71)55(73)34(6)83-48)59(37(9)86-50)92-49-23-44(72)58(81-13)36(8)85-49/h15-17,20-21,31-38,40-52,54-60,70-75H,18-19,22-28H2,1-14H3,(H,68,78)/b29-15-,30-20+,61-53+/t31-,32-,33+,34-,35-,36-,37-,38+,40+,41-,42-,43+,44+,45-,46+,47+,48-,49+,50-,51-,52-,54+,55-,56-,57-,58-,59-,60-,65-,66+,67?/m0/s1
External links:
PubChem link: https://pubchem.ncbi.nlm.nih.gov/compound/54681518
Citation: https://www.jstage.jst.go.jp/article/antibiotics1968/34/9/34_9_1101/_article/-char/en

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