Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA016176
PROPERTIES
NPAID | NPA016176 |
---|---|
CLUSTER ID | 579 |
NODE ID | 516 |
NAME | Polyoxypeptin |
FORMULA | C45H76N8O15 |
MOLECULAR WEIGHT (Da) | 969.1440 |
ACCURATE MASS (Da) | 968.5430 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Streptomyces |
ORIGIN SPECIES | sp. |
InChIKey | IHVXCLXQTOSBMJ-FINQWCIQSA-N |
InChI | InChI=1S/C45H76N8O15/c1-11-25(7)20-27-15-16-45(64,68-31(27)12-2)44(10,63)42(61)48-32-34(24(5)6)67-41(60)33(23(3)4)53(66)40(59)35-43(9,62)17-19-49(35)37(56)30-21-28(54)22-47-51(30)36(55)26(8)52(65)38(57)29-14-13-18-46-50(29)39(32)58/h23-35,46-47,54,62-66H,11-22H2,1-10H3,(H,48,61)/t25-,26-,27+,28+,29+,30+,31+,32-,33-,34-,35+,43+,44+,45+/m0/s1 |
SMILES | CC[C@@H]1[C@H](CC[C@@](O1)([C@@](C)(C(=O)N[C@H]2[C@@H](OC(=O)[C@@H](N(C(=O)[C@@H]3[C@](CCN3C(=O)[C@H]4C[C@H](CNN4C(=O)[C@@H](N(C(=O)[C@H]5CCCNN5C2=O)O)C)O)(C)O)O)C(C)C)C(C)C)O)O)C[C@@H](C)CC |
ORIGINAL ISOLATION REFERENCE
CITATION | Umezawa, Kazuo; Nakazawa, Kumi; Uemura, Toshio; Ikeda, Yoko; Kondo, Shinichi; Naganawa, Hiroshi; Kinoshita, Naoko; Hashizume, Hideki; Hamada, Masa; Takeuchi, Tomio; Ohba, Shigeru Polyoxypeptin isolated from Streptomyces: A bioactive cyclic depsipeptide containing the novel amino acid 3-hydroxy-3-methylproline Tetrahedron Letters 1998 39 (11) 1389-1392. | ||
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DOI | 10.1016/s0040-4039(98)00031-8 | PMID | - |