Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA011634
PROPERTIES
| NPAID | NPA011634 |
|---|---|
| CLUSTER ID | 263 |
| NODE ID | 141 |
| NAME | Hypelcin B-IV |
| FORMULA | C89H152N22O25 |
| MOLECULAR WEIGHT (Da) | 1930.3240 |
| ACCURATE MASS (Da) | 1929.1299 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Hypocrea |
| ORIGIN SPECIES | peltata |
| InChIKey | GWPGLZWAOJFLFK-UHFFFAOYSA-N |
| InChI | InChI=1S/C89H152N22O25/c1-29-47(6)61(99-74(131)82(13,14)103-65(122)53(35-38-57(91)115)97-73(130)84(17,18)107-76(133)86(21,22)102-62(119)48(7)93-71(128)81(11,12)104-67(124)55-33-31-41-111(55)78(135)88(25,26)100-49(8)113)69(126)106-80(9,10)70(127)92-43-58(116)101-85(19,20)75(132)109-89(27,28)79(136)110-40-30-32-54(110)66(123)98-60(46(4)5)68(125)105-87(23,24)77(134)108-83(15,16)72(129)96-52(36-39-59(117)118)64(121)95-51(34-37-56(90)114)63(120)94-50(44-112)42-45(2)3/h45-48,50-55,60-61,112H,29-44H2,1-28H3,(H2,90,114)(H2,91,115)(H,92,127)(H,93,128)(H,94,120)(H,95,121)(H,96,129)(H,97,130)(H,98,123)(H,99,131)(H,100,113)(H,101,116)(H,102,119)(H,103,122)(H,104,124)(H,105,125)(H,106,126)(H,107,133)(H,108,134)(H,109,132)(H,117,118) |
| SMILES | CCC(C)C(NC(=O)C(C)(C)NC(=O)C(CCC(N)=O)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(C)NC(=O)C(C)(C)NC(=O)C1CCCN1C(=O)C(C)(C)NC(C)=O)C(=O)NC(C)(C)C(=O)NCC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N1CCCC1C(=O)NC(C(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(CCC(O)=O)C(=O)NC(CCC(N)=O)C(=O)NC(CO)CC(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | MATSUURA, Kouji; SHIMA, Osamu; TAKEDA, Yoshio; TAKAISHI, Yoshihisa; NAGAOKA, Yasuo; FUJITA, Tetsuro Fungal Metabolites. XV. Primary Structures of Antibiotic Peptides, Hypelcins B-I, B-II, B-III, B-IV and B-V, from Hypocrea peltata. Application of Electrospray Mass Spectrometry and Electrospray Mass Spectrometry/Mass Spectrometry Chemical and Pharmaceutical Bulletin 1994 42 (5) 1063-1069. | ||
|---|---|---|---|
| DOI | 10.1248/cpb.42.1063 | PMID | 8069957 |
