Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA010701
PROPERTIES
NPAID | NPA010701 |
---|---|
CLUSTER ID | 36 |
NODE ID | 35 |
NAME | Monoacyldiglycosyl-monoacylglycerol |
FORMULA | C47H88O15 |
MOLECULAR WEIGHT (Da) | 893.2060 |
ACCURATE MASS (Da) | 892.6123 |
ORIGIN ORGANISM TYPE | Bacterium |
ORIGIN GENUS | Flavobacterium |
ORIGIN SPECIES | marinotypicum |
InChIKey | HKNIOPKHHLOIOT-UHFFFAOYSA-N |
InChI | InChI=1S/C47H88O15/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-38(50)57-32-35(49)33-59-46-44(56)45(62-47-43(55)42(54)40(52)36(31-48)60-47)41(53)37(61-46)34-58-39(51)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-37,40-49,52-56H,3-34H2,1-2H3 |
SMILES | CCCCCCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)OCC(COC(=O)CCCCCCCCCCCCCCC)O)O)OC2C(C(C(C(O2)CO)O)O)O)O |
ORIGINAL ISOLATION REFERENCE
CITATION | Yagi, Hisaaki; Maruyama, Akihiko A Novel Monoacyldiglycosyl-Monoacylglycerol from Flavobacterium marinotypicum Journal of Natural Products 1999 62 (4) 631-632. | ||
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DOI | 10.1021/np9804280 | PMID | 10217728 |