Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA008614
PROPERTIES
| NPAID | NPA008614 |
|---|---|
| CLUSTER ID | 263 |
| NODE ID | 141 |
| NAME | Atroviridin B |
| FORMULA | C93H153N23O24 |
| MOLECULAR WEIGHT (Da) | 1977.3840 |
| ACCURATE MASS (Da) | 1976.1459 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Trichoderma |
| ORIGIN SPECIES | atroviride |
| InChIKey | IPZQBZAEWOVJOO-UHFFFAOYSA-N |
| InChI | InChI=1S/C93H153N23O24/c1-26-93(25,83(138)104-57(37-40-63(95)120)71(126)103-56(36-39-62(94)119)70(125)100-55(47-117)45-54-32-28-27-29-33-54)114-82(137)90(19,20)113-76(131)66(49(4)5)105-74(129)60-34-30-42-115(60)85(140)92(23,24)110-73(128)59(44-48(2)3)101-65(122)46-97-78(133)86(11,12)112-77(132)67(50(6)7)106-81(136)89(17,18)109-72(127)58(38-41-64(96)121)102-68(123)51(8)98-79(134)87(13,14)108-69(124)52(9)99-80(135)88(15,16)111-75(130)61-35-31-43-116(61)84(139)91(21,22)107-53(10)118/h27-29,32-33,48-52,55-61,66-67,117H,26,30-31,34-47H2,1-25H3,(H2,94,119)(H2,95,120)(H2,96,121)(H,97,133)(H,98,134)(H,99,135)(H,100,125)(H,101,122)(H,102,123)(H,103,126)(H,104,138)(H,105,129)(H,106,136)(H,107,118)(H,108,124)(H,109,127)(H,110,128)(H,111,130)(H,112,132)(H,113,131)(H,114,137) |
| SMILES | CCC(C)(C(=O)NC(CCC(=O)N)C(=O)NC(CCC(=O)N)C(=O)NC(CC1=CC=CC=C1)CO)NC(=O)C(C)(C)NC(=O)C(C(C)C)NC(=O)C2CCCN2C(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)CNC(=O)C(C)(C)NC(=O)C(C(C)C)NC(=O)C(C)(C)NC(=O)C(CCC(=O)N)NC(=O)C(C)NC(=O)C(C)(C)NC(=O)C(C)NC(=O)C(C)(C)NC(=O)C3CCCN3C(=O)C(C)(C)NC(=O)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Oh, Seung-Uk; Lee, Sang-Jun; Kim, Jung-Han; Yoo, Ick-Dong Structural elucidation of new antibiotic peptides, atroviridins A, B and C from Trichoderma atroviride Tetrahedron Letters 2000 41 (1) 61-64. | ||
|---|---|---|---|
| DOI | 10.1016/s0040-4039(99)02000-6 | PMID | - |
