Compounds
ID | Spectrum Quality | Annotated Name |
---|---|---|
CCMSLIB00000577605 | Gold | 3 |
COMPOUND NPA003905
PROPERTIES
NPAID | NPA003905 |
---|---|
CLUSTER ID | 26 |
NODE ID | 26 |
NAME | [Val7]lichenysin G13 |
FORMULA | C50H88N8O12 |
MOLECULAR WEIGHT (Da) | 993.2980 |
ACCURATE MASS (Da) | 992.6522 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Bacillus |
ORIGIN SPECIES | licheniformis IM 1307 |
InChIKey | RLVTUVFCUNTCND-PWKIRCGZSA-N |
InChI | InChI=1S/C50H88N8O12/c1-13-32(12)18-16-14-15-17-19-33-25-40(60)52-34(20-21-39(51)59)44(63)53-35(22-27(2)3)45(64)54-36(23-28(4)5)47(66)57-42(30(8)9)49(68)56-38(26-41(61)62)46(65)55-37(24-29(6)7)48(67)58-43(31(10)11)50(69)70-33/h27-38,42-43H,13-26H2,1-12H3,(H2,51,59)(H,52,60)(H,53,63)(H,54,64)(H,55,65)(H,56,68)(H,57,66)(H,58,67)(H,61,62)/t32?,33?,34-,35-,36+,37+,38-,42-,43-/m0/s1 |
SMILES | CCC(C)CCCCCCC1CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)O1)C(C)C)CC(C)C)CC(=O)O)C(C)C)CC(C)C)CC(C)C)CCC(=O)N |
ORIGINAL ISOLATION REFERENCE
CITATION | GRANGEMARD, ISABELLE; BONMATIN, JEAN-MARC; BERNILLON, JACQUES; DAS, BHUPESH C.; PEYPOUX, FRANCHISE Lichenysins G, a Novel Family of Lipopeptide Biosurfactants from Bacillus licheniformis IM 1307: Production, Isolation and Structural Evaluation by NMR and Mass Spectrometry Journal of Antibiotics 1999 52 (4) 363-373. | ||
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DOI | 10.7164/antibiotics.52.363 | PMID | 10395272 |