Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA017098
PROPERTIES
| NPAID | NPA017098 |
|---|---|
| CLUSTER ID | 263 |
| NODE ID | 141 |
| NAME | Neoatroviridin A |
| FORMULA | C81H142N20O21 |
| MOLECULAR WEIGHT (Da) | 1732.1460 |
| ACCURATE MASS (Da) | 1731.0658 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Trichoderma |
| ORIGIN SPECIES | atroviride |
| InChIKey | JMKOYBUMBDANCQ-UHFFFAOYSA-N |
| InChI | InChI=1S/C81H142N20O21/c1-27-81(26,72(121)100-80(24,25)73(122)101-34-28-29-54(101)65(114)89-52(37-44(6)7)63(112)98-79(22,23)71(120)99-78(20,21)70(119)90-49(30-32-55(82)104)60(109)87-48(41-102)35-42(2)3)94-58(107)40-85-67(116)75(14,15)96-64(113)53(38-45(8)9)92-69(118)77(18,19)95-61(110)50(31-33-56(83)105)91-68(117)76(16,17)97-62(111)51(36-43(4)5)88-59(108)46(10)86-57(106)39-84-66(115)74(12,13)93-47(11)103/h42-46,48-54,102H,27-41H2,1-26H3,(H2,82,104)(H2,83,105)(H,84,115)(H,85,116)(H,86,106)(H,87,109)(H,88,108)(H,89,114)(H,90,119)(H,91,117)(H,92,118)(H,93,103)(H,94,107)(H,95,110)(H,96,113)(H,97,111)(H,98,112)(H,99,120)(H,100,121) |
| SMILES | CCC(C)(NC(=O)CNC(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)C(C)(C)NC(=O)C(CCC(N)=O)NC(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)CNC(=O)C(C)(C)NC(C)=O)C(=O)NC(C)(C)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(CCC(N)=O)C(=O)NC(CO)CC(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | OH, SEUNG-UK; YUN, BONG-SIK; LEE, SANG-JUN; KIM, JUNG-HAN; YOO, ICK-DONG Atroviridins A-C and Neoatroviridins A-D, Novel Peptaibol Antibiotics Produced by Trichoderma atroviride F80317. I. Taxonomy, Fermentation, Isolation and Biological Activities Journal of Antibiotics 2002 55 (6) 557-564. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.55.557 | PMID | 12195961 |
