Compounds
| ID | Spectrum Quality | Annotated Name |
|---|---|---|
| CCMSLIB00000854981 | Gold | 1!CCMSLIB00000854983 |
| CCMSLIB00012131367 | Gold | 4 |
| CCMSLIB00009971164 | Gold | 4 |
COMPOUND NPA010539
PROPERTIES
| NPAID | NPA010539 |
|---|---|
| CLUSTER ID | 57 |
| NODE ID | 53 |
| NAME | Aspochalasin H |
| FORMULA | C24H35NO5 |
| MOLECULAR WEIGHT (Da) | 417.5460 |
| ACCURATE MASS (Da) | 417.2515 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Aspergillus |
| ORIGIN SPECIES | sp. |
| InChIKey | MJNAZPNWAXZOTC-YDACEYOSSA-N |
| InChI | InChI=1S/C24H35NO5/c1-11(2)8-16-18-14(5)13(4)10-15-9-12(3)6-7-17(26)19(27)20-21(30-20)22(28)24(15,18)23(29)25-16/h9-11,14-21,26-27H,6-8H2,1-5H3,(H,25,29)/b12-9-/t14-,15?,16?,17-,18+,19-,20-,21-,24+/m1/s1 |
| SMILES | C[C@H]1[C@H]2C(NC(=O)[C@@]23C(/C=C(\CC[C@H]([C@H]([C@@H]4[C@H](C3=O)O4)O)O)/C)C=C1C)CC(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | TOMIKAWA, TAIJIRO; SHIN-YA, KAZUO; SETO, HARUO; OKUSA, NORIYUKI; KAJIURA, TAKAYUKI; HAYAKAWA, YOICHI Structure of Aspochalasin H, a New Member of the Aspochalasin Family Journal of Antibiotics 2002 55 (7) 666-668. | ||
|---|---|---|---|
| DOI | 10.7164/antibiotics.55.666 | PMID | 12243459 |
