Lycoctonine

chemical compound

Wikidata entity: Q15426214

C₂₅H₄₁NO₇ (P274)




Quantities

P2067mass467.288303

P233 canonical SMILES String CCN1CC2(CCC(C34C2C(C(C31)(C5(CC(C6CC4C5C6OC)OC)O)O)OC)OC)CO ???
P703 found in taxon ... Q145869 (Ranunculaceae) Ranunculaceae
P703 found in taxon ... Q158040 (Aconitum lycoctonum) Aconitum lycoctonum
P703 found in taxon ... Q164439 (Consolida ajacis) Consolida ajacis
P703 found in taxon ... Q2075615 (Aconitum fischeri) Aconitum fischeri
P703 found in taxon ... Q162815 (Forking Larkspur) Forking Larkspur
P703 found in taxon ... Q163383 (Consolida orientalis) Consolida orientalis
P703 found in taxon ... Q164246 (Delphinium elatum) Delphinium elatum
P703 found in taxon ... Q3017260 (Delphinium nuttallianum) Delphinium nuttallianum
P703 found in taxon ... Q4093585 (Aconitum barbatum) Aconitum barbatum
P703 found in taxon ... Q15246009 (Aconitum racemulosum) Aconitum racemulosum
P703 found in taxon ... Q15361735 (Aconitum rubicundum) Aconitum rubicundum
P703 found in taxon ... Q15362154 (Aconitum vulparia) Aconitum vulparia
P703 found in taxon ... Q15362617 (Aconitum septentrionale) Aconitum septentrionale
P703 found in taxon ... Q15369891 (Delphinium ambiguum) Delphinium ambiguum
P703 found in taxon ... Q4674498 (Aconitum lamarckii) Aconitum lamarckii
P703 found in taxon ... Q4753990 (Anderson's larkspur) Anderson's larkspur
P703 found in taxon ... Q5784257 (Consolida pubescens) Consolida pubescens
P703 found in taxon ... Q10885068 (Delphinium iliense) Delphinium iliense
P703 found in taxon ... Q10924488 (Delphinium brunonianum) Delphinium brunonianum
P703 found in taxon ... Q11179225 (Delphinium potaninii) Delphinium potaninii
P703 found in taxon ... Q39767036 (Delphinium pubescens) Delphinium pubescens
P703 found in taxon ... Q50839091 (Consolida ambigua) Consolida ambigua
P703 found in taxon ... Q50839129 (Delphinium zalil) Delphinium zalil
P703 found in taxon ... Q15370111 (Delphinium barbeyi) Delphinium barbeyi
P703 found in taxon ... Q15370736 (Delphinium albiflorum) Delphinium albiflorum
P703 found in taxon ... Q15370959 (Delphinium corymbosum) Delphinium corymbosum
P703 found in taxon ... Q12222111 (Delphinium semibarbatum) Delphinium semibarbatum
P703 found in taxon ... Q12222119 (Delphinium cashmerianum) Delphinium cashmerianum
P703 found in taxon ... Q15228375 (Delphinium caeruleum) Delphinium caeruleum
P703 found in taxon ... Q15371308 (Delphinium glaucescens) Delphinium glaucescens
P703 found in taxon ... Q15373017 (Delphinium occidentale) Delphinium occidentale
P703 found in taxon ... Q21873730 (Delphinium ajacis) Delphinium ajacis
P703 found in taxon ... Q50839494 (Delphinium oliverianum) Delphinium oliverianum
P703 found in taxon ... Q104390472 (Delphinium semibarbartum) Delphinium semibarbartum
P703 found in taxon ... Q21873742 (Delphinium consolida) Delphinium consolida
P703 found in taxon ... Q39766783 (Delphinium armeniacum) Delphinium armeniacum
P703 found in taxon ... Q39766983 (Delphinium orientale) Delphinium orientale
P31 instance of ... Q113145171 (type of chemical entity) type of chemical entity
P2017 isomeric SMILES String CCN1C[C@@]2(CC[C@@H]([C@@]34[C@@H]2[C@@H]([C@]([C@H]31)([C@]5(C[C@@H]([C@H]6C[C@@H]4[C@@H]5[C@H]6OC)OC)O)O)OC)OC)CO ???
P3364 stereoisomer of ... Q104888863 ((1S,2R,3R,4S,5R,6S,8R,9S,10S,13S,16S,17R,18S)-11-ethyl-13-(hydroxymethyl)-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9-diol) (1S,2R,3R,4S,5R,6S,8R,9S,10S,13S,16S,17R,18S)-11-ethyl-13-(hydroxymethyl)-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9-diol
P3364 stereoisomer of ... Q105351528 ((1S,2R,3R,4S,5R,6S,8R,9S,10S,13S,16S,17R,18R)-11-ethyl-13-(hydroxymethyl)-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9-diol) (1S,2R,3R,4S,5R,6S,8R,9S,10S,13S,16S,17R,18R)-11-ethyl-13-(hydroxymethyl)-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9-diol
P3364 stereoisomer of ... Q105351532 ((1S,2R,3R,4S,5R,6S,8R,9S,10S,13S,16R,17R,18S)-11-ethyl-13-(hydroxymethyl)-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9-diol) (1S,2R,3R,4S,5R,6S,8R,9S,10S,13S,16R,17R,18S)-11-ethyl-13-(hydroxymethyl)-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9-diol
P3364 stereoisomer of ... Q105351533 ((1S,2S,3R,4S,5R,6S,8R,9S,10S,13S,16S,17R,18S)-11-ethyl-13-(hydroxymethyl)-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9-diol) (1S,2S,3R,4S,5R,6S,8R,9S,10S,13S,16S,17R,18S)-11-ethyl-13-(hydroxymethyl)-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9-diol
P3364 stereoisomer of ... Q105351534 ((1S,2R,3R,4S,5R,6S,8R,9R,10S,13R,16S,17R,18S)-11-ethyl-13-(hydroxymethyl)-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9-diol) (1S,2R,3R,4S,5R,6S,8R,9R,10S,13R,16S,17R,18S)-11-ethyl-13-(hydroxymethyl)-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9-diol
P279 subclass of ... Q109416739 (aconitane alkaloid) aconitane alkaloid

External Ids
P231CAS Registry Number26000-17-9
P683ChEBI ID6590
P592ChEMBL IDCHEMBL517003
P661ChemSpider ID10145862
P8494DSSTOX compound identifierDTXCID601377117
P3117DSSTox substance IDDTXSID10948904
P646Freebase ID/m/0xnv9hj
P234InChIInChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20+,21+,22+,23-,24+,25+/m1/s1
P235InChIKeyYOTUXHIWBVZAJQ-VCDUNCIKSA-N
P235InChIKeyYOTUXHIWBVZAJQ-YAEAOFIFSA-N
P6689MassBank accession IDMSBNK-RIKEN-PR300383
P6689MassBank accession IDMSBNK-RIKEN-PR300388
P6689MassBank accession IDMSBNK-RIKEN-PR300393
P6689MassBank accession IDMSBNK-RIKEN-PR300398
P6689MassBank accession IDMSBNK-RIKEN-PR300403
P6689MassBank accession IDMSBNK-RIKEN-PR300408
P6689MassBank accession IDMSBNK-RIKEN-PR300413
P6689MassBank accession IDMSBNK-RIKEN-PR300418
P6689MassBank accession IDMSBNK-RIKEN-PR300423
P6689MassBank accession IDMSBNK-RIKEN-PR300428
P6689MassBank accession IDMSBNK-RIKEN-PR300433
P6689MassBank accession IDMSBNK-RIKEN-PR300437
P6366Microsoft Academic ID (discontinued)2776604394
P2840NSC number268791
P662PubChem CID11972492
P662PubChem CID441746
P2877SureChEMBL ID2570467
P11089UniChem compound ID577283
P652UNII0GLX1UNC80

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