Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA033486
PROPERTIES
| NPAID | NPA033486 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Scytocyclamide A |
| FORMULA | C61H98N12O14 |
| MOLECULAR WEIGHT (Da) | 1223.5250 |
| ACCURATE MASS (Da) | 1222.7325 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Scytonema |
| ORIGIN SPECIES | hofmannii PCC 7110 |
| InChIKey | FXNSTMGRWLTKFF-FVVOUXCPSA-N |
| InChI | InChI=1S/C61H98N12O14/c1-11-15-17-22-39-30-49(77)65-42(23-24-48(62)76)54(80)66-41(14-4)61(87)73-33-40(75)31-47(73)58(84)67-43(25-26-74)55(81)69-46(29-38-20-18-16-19-21-38)56(82)68-45(28-35(7)8)57(83)71-52(37(10)13-3)60(86)72-51(36(9)12-2)59(85)70-44(27-34(5)6)53(79)63-32-50(78)64-39/h14,16,18-21,34-37,39-40,42-47,51-52,74-75H,11-13,15,17,22-33H2,1-10H3,(H2,62,76)(H,63,79)(H,64,78)(H,65,77)(H,66,80)(H,67,84)(H,68,82)(H,69,81)(H,70,85)(H,71,83)(H,72,86)/t36-,37-,39?,40+,42-,43-,44-,45+,46+,47-,51+,52-/m0/s1 |
| SMILES | CC=C1NC(=O)[C@H](CCC(N)=O)NC(=O)CC(CCCCC)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]([C@@H](C)CC)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCO)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Heinilä, Lassi Matti Petteri; Fewer, David P.; Jokela, Jouni Kalevi; Wahlsten, Matti; Jortikka, Anna; Sivonen, Kaarina Shared PKS Module in Biosynthesis of Synergistic Laxaphycins Frontiers in Microbiology 2020 11 (nan) 578878. | ||
|---|---|---|---|
| DOI | 10.3389/fmicb.2020.578878 | PMID | 33042096 |
