Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA020770
PROPERTIES
| NPAID | NPA020770 |
|---|---|
| CLUSTER ID | 2605 |
| NODE ID | 2027 |
| NAME | Phenelfamycin E |
| FORMULA | C65H95NO21 |
| MOLECULAR WEIGHT (Da) | 1226.4610 |
| ACCURATE MASS (Da) | 1225.6397 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Streptomyces |
| ORIGIN SPECIES | violaceoniger AB 999F-80 |
| InChIKey | UDVVGDCMWCVRCO-DPXDKDKUSA-N |
| InChI | InChI=1S/C65H95NO21/c1-13-14-18-29-51-64(7,8)61(72)62(84-53(70)32-43-26-19-17-20-27-43)65(74,87-51)44(63(73)66-31-24-23-25-38(2)58(78-12)39(3)47-33-45(67)46(83-47)28-21-15-16-22-30-52(68)69)37-79-54-35-49(76-10)59(41(5)81-54)86-56-36-50(77-11)60(42(6)82-56)85-55-34-48(75-9)57(71)40(4)80-55/h13-30,39-42,44-51,54-62,67,71-72,74H,31-37H2,1-12H3,(H,66,73)(H,68,69)/b14-13-,16-15+,24-23+,28-21+,29-18+,30-22+,38-25+/t39-,40+,41-,42+,44-,45+,46+,47-,48+,49-,50-,51+,54-,55+,56-,57-,58-,59+,60+,61+,62-,65-/m1/s1 |
| SMILES | C/C=C\C=C\[C@H]1C([C@H]([C@H]([C@](O1)([C@H](CO[C@H]2C[C@H]([C@H]([C@H](O2)C)O[C@@H]3C[C@H]([C@H]([C@@H](O3)C)O[C@H]4C[C@@H]([C@@H]([C@@H](O4)C)O)OC)OC)OC)C(=O)NC/C=C/C=C(\C)/[C@H]([C@H](C)[C@H]5C[C@@H]([C@@H](O5)/C=C/C=C/C=C/C(=O)O)O)OC)O)OC(=O)CC6=CC=CC=C6)O)(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Hochlowski JE; Buytendorp MH; Whittern DN; Buko AM; Chen RH; McAlpine JB Phenelfamycins, a novel complex of elfamycin-type antibiotics. II. Isolation and structure determination Journal of Antibiotics 1988 41 (10) 1300-1315. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.41.1300 | PMID | 3192490 |
