Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA002063
PROPERTIES
| NPAID | NPA002063 |
|---|---|
| CLUSTER ID | 353 |
| NODE ID | 318 |
| NAME | Anafp |
| FORMULA | C96H151N29O33S2 |
| MOLECULAR WEIGHT (Da) | 2303.5680 |
| ACCURATE MASS (Da) | 2302.0471 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | niger |
| InChIKey | CESUCQNBEIJPAL-UHFFFAOYSA-N |
| InChI | InChI=1S/C96H151N29O33S2/c1-45(2)30-54(99)79(142)120-66(40-126)90(153)112-56(13-8-10-28-98)83(146)116-62(32-49-15-19-52(130)20-16-49)80(143)107-38-71(133)106-39-72(134)109-58(23-25-73(135)136)84(147)122-68(42-159)92(155)121-67(41-127)91(154)115-61(31-46(3)4)86(149)113-59(24-26-74(137)138)85(148)117-64(34-51-37-104-44-108-51)88(151)118-65(35-70(100)132)89(152)124-77(48(6)129)95(158)123-69(43-160)93(156)125-76(47(5)128)94(157)119-63(33-50-17-21-53(131)22-18-50)87(150)111-57(14-11-29-105-96(102)103)81(144)110-55(12-7-9-27-97)82(145)114-60(78(101)141)36-75(139)140/h15-22,37,44-48,54-69,76-77,126-131,159-160H,7-14,23-36,38-43,97-99H2,1-6H3,(H2,100,132)(H2,101,141)(H,104,108)(H,106,133)(H,107,143)(H,109,134)(H,110,144)(H,111,150)(H,112,153)(H,113,149)(H,114,145)(H,115,154)(H,116,146)(H,117,148)(H,118,151)(H,119,157)(H,120,142)(H,121,155)(H,122,147)(H,123,158)(H,124,152)(H,125,156)(H,135,136)(H,137,138)(H,139,140)(H4,102,103,105) |
| SMILES | CC(C)CC(C(=O)NC(CO)C(=O)NC(CCCCN)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)NCC(=O)NCC(=O)NC(CCC(=O)O)C(=O)NC(CS)C(=O)NC(CO)C(=O)NC(CC(C)C)C(=O)NC(CCC(=O)O)C(=O)NC(CC2=CNC=N2)C(=O)NC(CC(=O)N)C(=O)NC(C(C)O)C(=O)NC(CS)C(=O)NC(C(C)O)C(=O)NC(CC3=CC=C(C=C3)O)C(=O)NC(CCCNC(=N)N)C(=O)NC(CCCCN)C(=O)NC(CC(=O)O)C(=O)N)N |
ORIGINAL ISOLATION REFERENCE
| CITATION | Lee, Dong Gun; Shin, Song Yub; Maeng, Cheol-Young; Jin, Zhe Zhu; Kim, Kil Lyong; Hahm, Kyung-Soo Isolation and Characterization of a Novel Antifungal Peptide from Aspergillus niger Biochemical and Biophysical Research Communications 1999 263 (3) 646-651. | ||
|---|---|---|---|
| DOI | 10.1006/bbrc.1999.1428 | PMID | 10512732 |
