Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA013368
PROPERTIES
| NPAID | NPA013368 |
|---|---|
| CLUSTER ID | 1386 |
| NODE ID | 1164 |
| NAME | ZGL2 |
| FORMULA | C60H117N2O22P |
| MOLECULAR WEIGHT (Da) | 1249.5620 |
| ACCURATE MASS (Da) | 1248.7836 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Acremonium |
| ORIGIN SPECIES | sp. |
| InChIKey | QGIUPHXMTSDGSV-VNAYCNMSSA-N |
| InChI | InChI=1S/C60H117N2O22P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-42(65)58(76)62-40(46(66)41(64)35-33-31-29-27-25-16-14-12-10-8-6-4-2)38-80-85(77,78)84-57-54(74)52(72)51(71)53(73)56(57)83-59-45(61)49(69)48(68)44(82-59)39-79-60-55(75)50(70)47(67)43(37-63)81-60/h40-57,59-60,63-75H,3-39,61H2,1-2H3,(H,62,76)(H,77,78)/t40-,41?,42?,43+,44+,45+,46-,47+,48+,49+,50-,51-,52-,53+,54+,55-,56+,57-,59+,60-/m0/s1 |
| SMILES | CCCCCCCCCCCCCCCCCCCCCCC(C(=O)N[C@@H](COP(=O)(O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H]([C@H]1O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO[C@@H]3[C@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)N)O)O)O)O)[C@@H](C(CCCCCCCCCCCCCC)O)O)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Yamada-Hada, Junko; Hada, Noriyasu; Aoki, Kazuhiro; Yamamoto, Kenji; Takeda, Tadahiro Structural elucidation of novel phosphocholine-containing glycosylinositol-phosphoceramides in filamentus fungi: (2). Spectral analysis of the sugar-inositol portion by 2D-NMR Chemical and Pharmaceutical Bulletin 2004 52 (4) 473-476. | ||
|---|---|---|---|
| DOI | 10.1248/cpb.52.473 | PMID | 15056970 |
