Compounds
ID | Spectrum Quality | Annotated Name |
---|---|---|
CCMSLIB00000848237 | Gold | 1 |
CCMSLIB00000845121 | Gold | 1 |
COMPOUND NPA026352
PROPERTIES
NPAID | NPA026352 |
---|---|
CLUSTER ID | 106 |
NODE ID | 101 |
NAME | Penazaphilone G |
FORMULA | C46H54Cl2N2O8 |
MOLECULAR WEIGHT (Da) | 833.8500 |
ACCURATE MASS (Da) | 832.3257 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Penicillium |
ORIGIN SPECIES | sclerotiorum cib-411 |
InChIKey | GXUYGLKNAQMTRM-KNWFILBFSA-N |
InChI | InChI=1S/C46H54Cl2N2O8/c1-11-27(3)21-29(5)15-17-33-23-35-37(41(53)45(9,57-31(7)51)43(55)39(35)47)25-49(33)19-13-14-20-50-26-38-36(24-34(50)18-16-30(6)22-28(4)12-2)40(48)44(56)46(10,42(38)54)58-32(8)52/h15-18,21-28H,11-14,19-20H2,1-10H3/t27-,28-,45-,46-/m0/s1 |
SMILES | CC[C@H](C)C=C(C)C=CC1=CC2=C(Cl)C(=O)[C@@](C)(OC(C)=O)C(=O)C2=CN1CCCCN1C=C2C(=O)[C@](C)(OC(C)=O)C(=O)C(Cl)=C2C=C1C=CC(C)=C[C@@H](C)CC |
ORIGINAL ISOLATION REFERENCE
CITATION | Tang, Jia-Lin; Zhou, Zong-Yuan; Yang, Tao; Yao, Can; Wu, Lin-Wei; Li, Guo-You Azaphilone Alkaloids with Anti-inflammatory Activity from Fungus Penicillium sclerotiorum cib-411 Journal of Agricultural and Food Chemistry 2019 67 (8) 2175-2182. | ||
---|---|---|---|
DOI | 10.1021/acs.jafc.8b05628 | PMID | 30702881 |