Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA001321
PROPERTIES
| NPAID | NPA001321 |
|---|---|
| CLUSTER ID | 354 |
| NODE ID | 319 |
| NAME | Leucocin C-TA33a |
| FORMULA | C45H70N16O14S |
| MOLECULAR WEIGHT (Da) | 1091.2200 |
| ACCURATE MASS (Da) | 1090.4978 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Leuconostoc |
| ORIGIN SPECIES | mesenteroides |
| InChIKey | XNHDORMSXNDQMQ-NKHNYZCGSA-N |
| InChI | InChI=1S/C45H70N16O14S/c1-21(2)36(45(75)58-28(13-24-16-51-20-54-24)42(72)59-31(19-76)44(74)61-37(22(3)62)38(50)68)60-35(67)18-53-41(71)29(14-32(48)64)55-34(66)17-52-40(70)27(12-23-7-9-25(63)10-8-23)57-43(73)30(15-33(49)65)56-39(69)26(47)6-4-5-11-46/h7-10,16,20-22,26-31,36-37,62-63,76H,4-6,11-15,17-19,46-47H2,1-3H3,(H2,48,64)(H2,49,65)(H2,50,68)(H,51,54)(H,52,70)(H,53,71)(H,55,66)(H,56,69)(H,57,73)(H,58,75)(H,59,72)(H,60,67)(H,61,74)/t22-,26?,27?,28?,29?,30?,31?,36?,37?/m1/s1 |
| SMILES | C[C@H](C(C(=O)N)NC(=O)C(CS)NC(=O)C(CC1=CN=CN1)NC(=O)C(C(C)C)NC(=O)CNC(=O)C(CC(=O)N)NC(=O)CNC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C(CC(=O)N)NC(=O)C(CCCCN)N)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Papathanasopoulos, M. A.; Dykes, G. A.; Revol-Junelles, A.-M.; Delfour, A.; Holy, A. von; Hastings, J. W. Sequence and structural relationships of leucocins A-, B- and C-TA33a from Leuconostoc mesenteroides TA33a Microbiology 1998 144 (5) 1343-1348. | ||
|---|---|---|---|
| DOI | 10.1099/00221287-144-5-1343 | PMID | 9611809 |
