108460 <common-name>Ovatoxin-a</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id nil="true"/> <chemical-formula>C129H223N3O52</chemical-formula> <weight nil="true"/> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-04-05T15:33:41Z</created-at> <updated-at type="dateTime">2026-05-21T00:20:54Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>[H][C@]1(C[C@@H](O)[C@H](O)[C@@H](CC[C@H](O)C[C@H]2O[C@@H](C[C@H](O)C=C/C=C/C[C@@H](O)[C@H](O)[C@H](O)CC=C/C(=C)CC[C@H](O)[C@@H](O)[C@H](O)[C@H](C)C[C@H]3O[C@H](C=C/[C@@H](O)[C@H](O)C[C@@H]4C[C@@H]5C[C@H](O4)[C@@H](CC[C@H]4O[C@H](CN)C[C@H]4O)O5)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@@H](O)[C@@H]2O)O1)[C@@H](O)[C@H](O)CC[C@H](O)C=C[C@H](C)[C@@H](O)C[C@]1(O)O[C@@]([H])(C[C@@H](O)[C@H]1O)[C@@H](O)[C@@H](O)CCCCCCC[C@@]12C[C@@H](C)C[C@@](C)(O1)[C@@H](C[C@H](C)CCCCC[C@@H](O)[C@H](O)[C@H](O)C[C@H](O)[C@@]1([H])O[C@H](C[C@@H](O)[C@H](O)C(C)=C[C@H](O)C[C@@H](C)[C@H](O)C(=O)NC=CC(=O)NCCCO)[C@H](O)[C@@H](O)[C@@H]1O)O2</moldb-smiles> <moldb-formula>C129H223N3O52</moldb-formula> <moldb-inchi>InChI=1/C129H223N3O52/c1-64(29-34-84(144)114(162)107(155)70(7)49-98-116(164)120(168)115(163)96(179-98)38-36-78(138)85(145)53-75-52-76-55-97(176-75)94(175-76)40-39-93-86(146)54-77(63-130)177-93)23-20-28-81(141)109(157)79(139)25-18-13-15-24-72(135)50-99-117(165)121(169)118(166)100(180-99)51-73(136)33-37-95-113(161)89(149)58-101(178-95)111(159)83(143)35-32-71(134)31-30-67(4)92(152)62-129(174)125(172)91(151)59-103(182-129)112(160)82(142)27-16-10-9-11-19-42-128-61-66(3)60-127(8,184-128)104(183-128)46-65(2)22-14-12-17-26-80(140)110(158)87(147)56-90(150)124-123(171)122(170)119(167)102(181-124)57-88(148)106(154)68(5)47-74(137)48-69(6)108(156)126(173)132-44-41-105(153)131-43-21-45-133/h13,15,18,20,23-24,30-31,36,38,41,44,47,65-67,69-104,106-125,133-152,154-172,174H,1,9-12,14,16-17,19,21-22,25-29,32-35,37,39-40,42-43,45-46,48-63,130H2,2-8H3,(H,131,153)(H,132,173)/b18-13+,23-20-,24-15-,31-30+,38-36-,44-41+,68-47+/t65-,66+,67+,69-,70-,71-,72-,73+,74+,75+,76-,77+,78-,79-,80-,81-,82+,83-,84+,85-,86-,87-,88-,89-,90+,91-,92+,93-,94-,95-,96-,97+,98-,99+,100-,101+,102-,103+,104-,106-,107-,108+,109+,110+,111+,112+,113+,114-,115-,116+,117+,118-,119+,120+,121-,122-,123+,124-,125-,127-,128+,129+/s2</moldb-inchi> <moldb-inchikey>RZASWFCAHPACCD-FAXBYDSISA-N</moldb-inchikey> <moldb-average-mass type="decimal">2648.172</moldb-average-mass> <moldb-mono-mass type="decimal">2646.489764</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM104353</chemdb-id> <dsstox-id>DTXSID90880111</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00075615</susdat-id> <iupac nil="true"/> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> </compound>