Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA010051
PROPERTIES
| NPAID | NPA010051 |
|---|---|
| CLUSTER ID | 2347 |
| NODE ID | 141 |
| NAME | Microviridin F |
| FORMULA | C82H102N14O26 |
| MOLECULAR WEIGHT (Da) | 1699.7900 |
| ACCURATE MASS (Da) | 1698.7090 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Cyanobacterium |
| ORIGIN SPECIES | sp. |
| InChIKey | SHWUZQNDUBCUPN-GJAORIDRSA-N |
| InChI | InChI=1S/C82H102N14O26/c1-44(99)69(95-78(116)64(43-98)93-72(110)56(84-45(2)100)35-46-13-6-4-7-14-46)80(118)90-58(37-48-19-25-51(101)26-20-48)74(112)85-54-17-10-11-33-83-66(104)40-59(75(113)92-62(82(120)121)39-50-23-29-53(103)30-24-50)88-71(109)55(31-32-68(107)122-3)86-73(111)57(36-47-15-8-5-9-16-47)87-76(114)60(41-67(105)106)89-77(115)63(42-97)94-79(117)65-18-12-34-96(65)81(119)61(91-70(54)108)38-49-21-27-52(102)28-22-49/h4-9,13-16,19-30,44,54-65,69,97-99,101-103H,10-12,17-18,31-43H2,1-3H3,(H,83,104)(H,84,100)(H,85,112)(H,86,111)(H,87,114)(H,88,109)(H,89,115)(H,90,118)(H,91,108)(H,92,113)(H,93,110)(H,94,117)(H,95,116)(H,105,106)(H,120,121)/t44-,54+,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,69+/m1/s1 |
| SMILES | C[C@H]([C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@H]2CCCCNC(=O)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]3CCCN3C(=O)[C@@H](NC2=O)CC4=CC=C(C=C4)O)CO)CC(=O)O)CC5=CC=CC=C5)CCC(=O)OC)C(=O)N[C@@H](CC6=CC=C(C=C6)O)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC7=CC=CC=C7)NC(=O)C)O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Shin, Hee Jae; Murakami, Masahiro; Matsuda, Hisashi; Yamaguchi, Katsumi Microviridins D-F, serine protease inhibitors from the cyanobacterium Oscillatoria agardhii (NIES-204) Tetrahedron 1996 52 (24) 8159-8168. | ||
|---|---|---|---|
| DOI | 10.1016/0040-4020(96)00377-8 | PMID | - |
