Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA007745
PROPERTIES
| NPAID | NPA007745 |
|---|---|
| CLUSTER ID | 26 |
| NODE ID | 25 |
| NAME | Lobocyclamide B |
| FORMULA | C65H115N13O20 |
| MOLECULAR WEIGHT (Da) | 1398.7060 |
| ACCURATE MASS (Da) | 1397.8381 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Unknown-fungus |
| ORIGIN SPECIES | sp. |
| InChIKey | HUGDRGVGWFSHET-WJFFKZKPSA-N |
| InChI | InChI=1S/C65H115N13O20/c1-16-18-19-20-21-22-38-26-45(85)71-46(31(5)6)58(91)76-50(53(86)32(7)8)61(94)67-35(12)55(88)75-51(54(87)33(9)10)62(95)69-40(23-24-44(66)84)64(97)77(15)52(34(11)17-2)63(96)74-49(43(83)29-79)60(93)73-48(37(14)81)65(98)78-28-39(82)27-42(78)57(90)70-41(25-30(3)4)56(89)72-47(36(13)80)59(92)68-38/h30-43,46-54,79-83,86-87H,16-29H2,1-15H3,(H2,66,84)(H,67,94)(H,68,92)(H,69,95)(H,70,90)(H,71,85)(H,72,89)(H,73,93)(H,74,96)(H,75,88)(H,76,91)/t34?,35-,36+,37+,38+,39+,40+,41+,42-,43-,46-,47-,48-,49+,50?,51+,52-,53-,54-/m0/s1 |
| SMILES | CCCCCCC[C@@H]1CC(=O)N[C@H](C(=O)NC(C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N2C[C@@H](C[C@H]2C(=O)N[C@@H](C(=O)N[C@H](C(=O)N1)[C@@H](C)O)CC(C)C)O)[C@@H](C)O)[C@H](CO)O)C(C)CC)C)CCC(=O)N)[C@H](C(C)C)O)C)[C@H](C(C)C)O)C(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Williams, Philip G; Yoshida, Wesley Y; Moore, Richard E; Paul, Valerie J Isolation and structure determination of obyanamide, a novel cytotoxic cyclic depsipeptide from the marine cyanobacterium Lyngbya confervoides Journal of Natural Products 2002 65 (1) 29-31. | ||
|---|---|---|---|
| DOI | 10.1021/np0102253 | PMID | - |
