108459 <common-name>Karlotoxin-2</common-name> <description nil="true"/> <cas nil="true"/> <pubchem-id nil="true"/> <chemical-formula>C67H121ClO24</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">2026-04-05T15:33:11Z</created-at> <updated-at type="dateTime">2026-05-21T00:20:28Z</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](C)CCC[C@@H](O)[C@H](O)[C@H](O)[C@@H](C)CC[C@@H](O)[C@H](O)[C@H](C)C[C@@H](O)CCC[C@@H](O)CCC[C@@H](O)C=CC[C@@H](O)CO)O[C@]([H])([C@@H](O)CCC(=C)[C@H](O)[C@H](O)[C@]2([H])C[C@H](O)[C@H](O)[C@]([H])(O2)[C@H](O)[C@@H](O)C=CCCCCCCCCC=CC=CCl)[C@@H](O)[C@H](O)[C@@H]1O</moldb-smiles> <moldb-formula>C67H121ClO24</moldb-formula> <moldb-inchi>InChI=1S/C67H121ClO24/c1-39(21-17-29-47(74)59(84)57(82)40(2)30-32-49(76)56(81)42(4)35-45(72)26-19-24-43(70)22-18-23-44(71)25-20-27-46(73)38-69)55(80)51(78)36-54-63(88)64(89)65(90)66(91-54)50(77)33-31-41(3)58(83)62(87)53-37-52(79)61(86)67(92-53)60(85)48(75)28-15-13-11-9-7-5-6-8-10-12-14-16-34-68/h12,14-16,20,25,28,34,39-40,42-67,69-90H,3,5-11,13,17-19,21-24,26-27,29-33,35-38H2,1-2,4H3/b14-12+,25-20+,28-15+,34-16+/t39-,40+,42-,43+,44-,45+,46-,47-,48+,49-,50+,51-,52+,53+,54-,55-,56-,57-,58+,59+,60-,61+,62-,63-,64-,65+,66-,67-/m1/s1</moldb-inchi> <moldb-inchikey>KXZUDPZWHWYFBO-UREYIDQPSA-N</moldb-inchikey> <moldb-average-mass type="decimal">1346.13</moldb-average-mass> <moldb-mono-mass type="decimal">1344.793632</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>CHEM104352</chemdb-id> <dsstox-id>DTXSID70880114</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00075608</susdat-id> <iupac>(28S)-13,17:24,28-Dianhydro-28-[(1R,2S,3E,13E,15E)-16-chloro-1,2-dihydroxyhexadeca-3,13,15-trien-1-yl]-1,2,6,7,8,9,12,19,20,21,25-undecadeoxy-2-[(3R,4R,5R,7S,11R,15R,16E,19R)-3,4,7,11,15,19,20-heptahydroxy-5-methylicos-16-en-1-yl]-9-methyl-21-methylidene-D-erythro-L-galacto-D-manno-L-gulo-D-talo-octacositol</iupac> <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>