paxilline
chemical compound
Facts
9 properties- Instance of
- type of chemical entity
- Subclass of
- indole-diterpenoid alkaloid[4]
- Canonical SMILES
- CC12CCC3C(=CC(=O)C(O3)C(C)(C)O)C1(CCC4C2(C5=C(C4)C6=CC=CC=C6N5)C)O[2]
- Chemical formula
- C₂₇H₃₃NO₄[3]
- Found in taxon
- Lolium perenne, Emericella desertorum, Penicillium miczynskii, Penicillium paxilli, Claviceps paspali, Penicillium thiersii, Penicillium camemberti, Aspergillus striatus, Aspergillus foveolatus[5][6][7][8][9][10][11][12]
- Isomeric SMILES
- C[C@]12CC[C@H]3C(=CC(=O)[C@H](O3)C(C)(C)O)[C@@]1(CC[C@@H]4[C@@]2(C5=C(C4)C6=CC=CC=C6N5)C)O
- Mass
- +435.241
- Stereoisomer of
- (1S,2R,5S,7S,11S,14S)-11-hydroxy-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-6-oxa-23-azahexacyclo[12.10.0.02,11.05,10.016,24.017,22]tetracosa-9,16(24),17,19,21-pentaen-8-one
- Subject has role
- potassium channel blocker
🏷️ Also known as
en paxilline
fa پاکسیلین
pt paxilina
🔖 Identifiers · 24
- CAS Registry Number
- 57186-25-1
- ChEBI ID
- 34907
- ChEMBL ID
- CHEMBL410063
- ChemSpider ID
- 94753
- DSSTOX compound identifier
- DTXCID001400110
- DSSTox substance ID
- DTXSID10972643
- EC number
- 637-206-0
- ECHA Substance Infocard ID
- 100.164.932
- Freebase ID
- /m/04yd8q7
- Human Metabolome Database ID
- HMDB0030323
- InChIKey
- ACNHBCIZLNNLRS-UBGQALKQSA-N
Show all 24 identifiers +12
🔗 Connections
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Summary
paxilline is a type of chemical entity[1].