Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA012635
PROPERTIES
| NPAID | NPA012635 |
|---|---|
| CLUSTER ID | 2925 |
| NODE ID | 2247 |
| NAME | Gassericin B2 |
| FORMULA | C43H77N13O14S |
| MOLECULAR WEIGHT (Da) | 1032.2330 |
| ACCURATE MASS (Da) | 1031.5434 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Lactobacillus |
| ORIGIN SPECIES | gasseri |
| InChIKey | AVEZLZYNAVAHHU-UMJHPYLWSA-N |
| InChI | InChI=1S/C43H77N13O14S/c1-5-22(2)33(54-36(63)24(46)21-71-4)42(69)53-29(20-57)40(67)51-27(12-7-9-17-45)43(70)56-18-10-13-30(56)41(68)50-26(14-15-32(60)61)38(65)49-25(11-6-8-16-44)37(64)52-28(19-31(47)59)39(66)55-34(23(3)58)35(48)62/h22-30,33-34,57-58H,5-21,44-46H2,1-4H3,(H2,47,59)(H2,48,62)(H,49,65)(H,50,68)(H,51,67)(H,52,64)(H,53,69)(H,54,63)(H,55,66)(H,60,61)/t22?,23-,24?,25?,26?,27?,28?,29?,30?,33?,34+/m0/s1 |
| SMILES | CCC(C)C(C(=O)NC(CO)C(=O)NC(CCCCN)C(=O)N1CCCC1C(=O)NC(CCC(=O)O)C(=O)NC(CCCCN)C(=O)NC(CC(=O)N)C(=O)N[C@H]([C@H](C)O)C(=O)N)NC(=O)C(CSC)N |
ORIGINAL ISOLATION REFERENCE
| CITATION | Tahara, T; Yoshioka, S; Utsumi, R; Kanatani, K Isolation and partial characterization of bacteriocins produced by Lactobacillus gasseri JCM 2124 FEMS Microbiology Letters 1997 148 (1) 97-100. | ||
|---|---|---|---|
| DOI | 10.1016/s0378-1097(97)00019-0 | PMID | - |
