{"id":13527,"npaid":"NPA013527","original_name":"Camphoratin I","mol_formula":"C28H44O2","mol_weight":"412.6580","exact_mass":"412.3341","inchikey":"HCQKGAYOZHKURE-CXXKJJTHSA-N","smiles":"C[C@H](CO)[C@@H](C)C=C[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC[C@@H]4[C@@]3(CCC(=O)C4)C)C","cluster_id":69,"node_id":64,"has_exclusions":false,"synonyms":[],"inchi":"InChI=1S/C28H44O2/c1-18(20(3)17-29)6-7-19(2)24-10-11-25-23-9-8-21-16-22(30)12-14-27(21,4)26(23)13-15-28(24,25)5/h6-7,9,18-21,24-26,29H,8,10-17H2,1-5H3/t18-,19+,20+,21-,24+,25-,26-,27-,28+/m0/s1","m_plus_h":"413.3414","m_plus_na":"435.3233","origin_reference":{"doi":"10.1021/np1002143","pmid":21028898,"authors":"Wu, Shwu-Jen; Leu, Yann-Lii; Chen, Chou-Hsiung; Chao, Chih-Hua; Shen, De-Yang; Chan, Hsiu-Hui; Lee, E-Jian; Wu, Tian-Shung; Wang, Yea-Hwey; Shen, Yuh-Chiang; Qian, Keduo; Bastow, Kenneth F.; Lee, Kuo-Hsiung","title":"Camphoratins A-J, potent cytotoxic and anti-inflammatory triterpenoids from the fruiting body of Taiwanofungus camphoratus","journal":"Journal of Natural Products","year":2010,"volume":"73","issue":"11","pages":"1756-1762"},"origin_organism":{"id":999,"type":"Fungus","genus":"Taiwanofungus","species":"camphoratus","taxon":{"id":1577,"name":"Taiwanofungus","rank":"genus","taxon_db":"mycobank","external_id":"532851","ncbi_id":320360,"ancestors":[{"id":599,"name":"Eukarya","rank":"domain","taxon_db":"mycobank","external_id":"0","ncbi_id":2759},{"id":600,"name":"Fungi","rank":"kingdom","taxon_db":"mycobank","external_id":"90157","ncbi_id":4751},{"id":1365,"name":"Basidiomycota","rank":"phylum","taxon_db":"mycobank","external_id":"90050","ncbi_id":5204},{"id":1366,"name":"Agaricomycetes","rank":"class","taxon_db":"mycobank","external_id":"501297","ncbi_id":155619},{"id":1511,"name":"Polyporales","rank":"order","taxon_db":"mycobank","external_id":"90565","ncbi_id":5303}]}},"syntheses":[],"reassignments":[],"mol_structures":[{"current_structure":true,"reference_doi":"10.1021/np1002143","structure_smiles":"C[C@H](CO)[C@@H](C)C=C[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC[C@@H]4[C@@]3(CCC(=O)C4)C)C","is_reassignment":false,"version":1}],"exclusions":[],"external_ids":[{"external_db_name":"npmrd","external_db_code":"NP0009537"}],"classyfire":{"class":{"url":"http://classyfire.wishartlab.com/tax_nodes/C0000258","name":"Steroids and steroid derivatives","chemont_id":"CHEMONTID:0000258","description":"Compounds based on the cyclopenta[a]phenanthrene carbon skeleton, partially or completely hydrogenated; there are usually methyl groups at C-10 and C-13, and often an alkyl group at C-17. 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