Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00012166151 | Gold | 4 |
| CCMSLIB00012166152 | Gold | 4 |
| CCMSLIB00010005948 | Gold | 4 |
| CCMSLIB00010005949 | Gold | 4 |
| CCMSLIB00000223994 | Gold | 3 |
COMPOUND NPA032798
PROPERTIES
| NPAID | NPA032798 |
|---|---|
| CLUSTER ID | 1717 |
| NODE ID | 135 |
| NAME | Nostopeptolide A1 |
| FORMULA | C53H80N10O14 |
| MOLECULAR WEIGHT (Da) | 1081.2790 |
| ACCURATE MASS (Da) | 1080.5855 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Nostoc |
| ORIGIN SPECIES | sp. GSV224 |
| InChIKey | VJNXGGVCMFEVSM-ZABMOCCYSA-N |
| InChI | InChI=1S/C53H80N10O14/c1-9-12-43(67)61-46(31(8)10-2)50(73)60-38-27-77-53(76)39-13-11-18-62(39)51(74)37(22-32-14-16-33(64)17-15-32)59-48(71)36(23-42(54)66)57-45(69)25-55-47(70)35(20-29(5)6)56-44(68)24-41(65)34(19-28(3)4)58-49(72)40-21-30(7)26-63(40)52(38)75/h14-17,28-31,34-40,46,64H,9-13,18-27H2,1-8H3,(H2,54,66)(H,55,70)(H,56,68)(H,57,69)(H,58,72)(H,59,71)(H,60,73)(H,61,67)/t30-,31-,34-,35-,36-,37-,38-,39-,40-,46-/m0/s1 |
| SMILES | CCCC(=O)N[C@H](C(=O)N[C@H]1COC(=O)[C@@H]2CCCN2C(=O)[C@H](CC2=CC=C(O)C=C2)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CC(=O)[C@H](CC(C)C)NC(=O)[C@@H]2C[C@H](C)CN2C1=O)[C@@H](C)CC |
ORIGINAL ISOLATION REFERENCE
| CITATION | Golakoti, Trimurtulu; Yoshida, Wesley Y.; Chaganty, Sreedhara; Moore, Richard E. Isolation and structures of nostopeptolides A1, A2 and A3 from the cyanobacterium Nostoc sp. GSV224 Tetrahedron 2000 56 (46) 9093-9102. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4020(00)00764-x | PMID | - |
