Compounds
ID | Spectrum Quality | Annotated Name |
---|
COMPOUND NPA027818
PROPERTIES
NPAID | NPA027818 |
---|---|
CLUSTER ID | 57 |
NODE ID | 53 |
NAME | Phomocytochalasin A |
FORMULA | C31H41NO5 |
MOLECULAR WEIGHT (Da) | 507.6710 |
ACCURATE MASS (Da) | 507.2985 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Phomopsis |
ORIGIN SPECIES | asparagi |
InChIKey | KYPVMFRLDNPIBD-RHHBANPHSA-N |
InChI | InChI=1S/C31H41NO5/c1-6-26(33)37-25-15-16-30(5,36)18-19(2)11-10-14-23-28(34)21(4)20(3)27-24(32-29(35)31(23,25)27)17-22-12-8-7-9-13-22/h7-10,12-16,19-20,23-25,27-28,34,36H,4,6,11,17-18H2,1-3,5H3,(H,32,35)/b14-10+,16-15+/t19-,20+,23-,24-,25+,27-,28+,30-,31+/m0/s1 |
SMILES | C=C1[C@@H](O)[C@@H]2/C=C/C[C@H](C)C[C@@](C)(O)/C=C/[C@@H](OC(=O)CC)[C@]23C(=O)N[C@@H](CC2=CC=CC=C2)[C@@H]3[C@@H]1C |
ORIGINAL ISOLATION REFERENCE
CITATION | Chang, Hsun-Shuo; Peng, Chien-Jou; Cheng, Ming-Jen; Wu, Ho-Cheng; Chan, Hing-Yuen; Hsieh, Sung-Yuan; Yuan, Gwo-Fang; Chen, Ih-Sheng Chemical Constituents of the Endophytic Fungus Phomopsis asparagi Isolated from the Plant Peperomia sui Chemistry of Natural Compounds 2018 54 (3) 504-508. | ||
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DOI | 10.1007/s10600-018-2390-3 | PMID | - |