Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA018390
PROPERTIES
| NPAID | NPA018390 |
|---|---|
| CLUSTER ID | 918 |
| NODE ID | 795 |
| NAME | Not named |
| FORMULA | C25H27NO8 |
| MOLECULAR WEIGHT (Da) | 469.4900 |
| ACCURATE MASS (Da) | 469.1737 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Monascus |
| ORIGIN SPECIES | sp. |
| InChIKey | JKTFAORQBJNZHV-NXXNKLQJSA-N |
| InChI | InChI=1S/C25H27NO8/c1-4-6-7-9-19(27)21-17-11-14-10-15(8-5-2)26(18(23(31)32)12-20(28)29)13-16(14)22(30)25(17,3)34-24(21)33/h5,8,10-11,13,18H,4,6-7,9,12H2,1-3H3,(H,28,29)(H,31,32)/b8-5+/t18-,25+/m0/s1 |
| SMILES | CCCCCC(=O)C1=C2C=C3C=C(N(C=C3C(=O)[C@@]2(OC1=O)C)[C@@H](CC(=O)O)C(=O)O)/C=C/C |
ORIGINAL ISOLATION REFERENCE
| CITATION | SATO, Kyoko; GODA, Yukihiro; Sasaki, Shiho SAKAMOTO; SHIBATA, Hiroshi; MAITANI, Tamio; YAMADA, Takashi Identification of Major Pigments Containing D-Amino Acid Units in Commercial Monascus Pigments Chemical and Pharmaceutical Bulletin 1997 45 (1) 227-229. | ||
|---|---|---|---|
| DOI | 10.1248/cpb.45.227 | PMID | - |
