Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00010128610 | Gold | 3 |
COMPOUND NPA027356
PROPERTIES
| NPAID | NPA027356 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Trichormamide B |
| FORMULA | C69H115N13O20 |
| MOLECULAR WEIGHT (Da) | 1446.7500 |
| ACCURATE MASS (Da) | 1445.8381 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Trichormus |
| ORIGIN SPECIES | sp. UIC 10339 |
| InChIKey | MSGPXZILSHWDOB-ZXSGCDKOSA-N |
| InChI | InChI=1S/C69H115N13O20/c1-13-16-17-18-19-21-42-33-50(89)76-51(37(8)14-2)63(96)80-55(58(91)36(6)7)65(98)72-44(29-31-83)59(92)79-54(57(90)35(4)5)66(99)73-45(27-28-49(70)88)68(101)81(12)56(38(9)15-3)67(100)75-47(34-84)61(94)78-53(40(11)86)69(102)82-30-20-22-48(82)62(95)74-46(32-41-23-25-43(87)26-24-41)60(93)77-52(39(10)85)64(97)71-42/h23-26,35-40,42,44-48,51-58,83-87,90-91H,13-22,27-34H2,1-12H3,(H2,70,88)(H,71,97)(H,72,98)(H,73,99)(H,74,95)(H,75,100)(H,76,89)(H,77,93)(H,78,94)(H,79,92)(H,80,96)/t37-,38-,39+,40+,42+,44-,45-,46+,47+,48-,51-,52-,53-,54+,55+,56-,57-,58-/m0/s1 |
| SMILES | CCCCCCC[C@@H]1CC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@H]([C@@H](O)C(C)C)C(=O)N[C@@H](CCO)C(=O)N[C@H]([C@@H](O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N(C)[C@@H]([C@@H](C)CC)C(=O)N[C@H](CO)C(=O)N[C@@H]([C@@H](C)O)C(=O)N2CCC[C@H]2C(=O)N[C@H](CC2=CC=C(O)C=C2)C(=O)N[C@@H]([C@@H](C)O)C(=O)N1 |
ORIGINAL ISOLATION REFERENCE
| CITATION | Luo S; Krunic A; Kang HS; Chen WL; Woodard JL; Fuchs JR; Swanson SM; Orjala J Trichormamides A and B with Antiproliferative Activity from the Cultured Freshwater Cyanobacterium Trichormus sp. UIC 10339. Journal of Natural Products 2014 77 (8) 1871-1880. | ||
|---|---|---|---|
| DOI | 10.1021/np5003548 | PMID | 25089652 |
