Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA018269
PROPERTIES
| NPAID | NPA018269 |
|---|---|
| CLUSTER ID | 3106 |
| NODE ID | 2371 |
| NAME | Stictamide C |
| FORMULA | C42H56N6O8 |
| MOLECULAR WEIGHT (Da) | 772.9440 |
| ACCURATE MASS (Da) | 772.4160 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Sticta |
| ORIGIN SPECIES | sp. |
| InChIKey | LJZRCNQLPJLGAY-HQPLKVBUSA-N |
| InChI | InChI=1S/C42H56N6O8/c1-28(2)22-24-45-42(43)44-23-8-12-34(46-38(52)13-7-11-29-14-18-32(49)19-15-29)40(54)48-35(25-30-9-5-4-6-10-30)37(51)27-39(53)47-36(41(55)56-3)26-31-16-20-33(50)21-17-31/h4-6,9-10,14-22,34-37,49-51H,7-8,11-13,23-27H2,1-3H3,(H,46,52)(H,47,53)(H,48,54)(H3,43,44,45)/t34-,35+,36+,37+/m1/s1 |
| SMILES | CC(=CCN=C(N)NCCC[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)[C@H](CC(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)OC)O)NC(=O)CCCC3=CC=C(C=C3)O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Liang, Zhibin; Sorribas, Analia; Sulzmaier, Florian J.; Jimenez, Jorge I.; Wang, Xin; Sauvage, Thomas; Yoshida, Wesley Y.; Wang, Guangyi; Ramos, Joe W.; Williams, Philip G. Stictamides A-C, MMP12 inhibitors containing 4-amino-3-hydroxy-5- phenylpentanoic acid subunits Journal of Organic Chemistry 2011 76 (10) 3635-3643. | ||
|---|---|---|---|
| DOI | 10.1021/jo200241h | PMID | 21500817 |
