Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA000017
PROPERTIES
| NPAID | NPA000017 |
|---|---|
| CLUSTER ID | 16 |
| NODE ID | 16 |
| NAME | Macrolactin P |
| FORMULA | C31H46O10 |
| MOLECULAR WEIGHT (Da) | 578.6990 |
| ACCURATE MASS (Da) | 578.3091 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Bacillus |
| ORIGIN SPECIES | sp. AH159-1 |
| InChIKey | SVHVXVRYDBFIMU-JHHGODBBSA-N |
| InChI | InChI=1S/C31H46O10/c1-2-24-16-10-5-3-4-8-14-22(33)20-23(34)15-9-6-11-17-25(18-12-7-13-19-27(35)39-24)40-31-30(38)29(37)28(36)26(21-32)41-31/h3-4,6-9,11-14,17,19,22-26,28-34,36-38H,2,5,10,15-16,18,20-21H2,1H3/b4-3+,9-6-,12-7+,14-8+,17-11+,19-13-/t22-,23-,24+,25+,26+,28+,29-,30+,31+/m0/s1 |
| SMILES | CC[C@@H]1CCC/C=C/C=C/[C@@H](C[C@H](C/C=C\C=C\[C@H](C/C=C/C=C\C(=O)O1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Zheng, Chang-Ji; Lee, Sangku; Lee, Choong-Hwan; Kim, Won-Gon Macrolactins O-R, glycosylated 24-membered lactones from Bacillus sp. AH159-1 Journal of Natural Products 2007 70 (10) 1632-1635. | ||
|---|---|---|---|
| DOI | 10.1021/np0701327 | PMID | 17887720 |
