Dehydrobufotenine

AlkaPlorer ID: AK116978

Synonym: 1,3,4,5-Tetrahydro-6-hydroxy-5,5-dimethylpyrrolo[4,3,2-de]quinolinium 

IUPAC Name: 7,7-dimethyl-2-aza-7-azoniatricyclo[6.3.1.04,12]dodeca-1(12),3,8,10-tetraen-9-ol

Structure

SMILES: C[N+]1(C)CCC2=CNC3=CC=C(O)C1=C23

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InChI: InChI=1S/C12H14N2O/c1-14(2)6-5-8-7-13-9-3-4-10(15)12(14)11(8)9/h3-4,7,13H,5-6H2,1-2H3/p+1

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InChIKey: XRZDSPVDZKCARG-UHFFFAOYSA-O

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Reference

PubChem CID: 205042

CAS: 17232-69-8

NPASS: NPC76582

COCONUT: CNP0421639

Source

Properties Information

Molecule Weight: 203.265

TPSA: 36.02

MolLogP: 1.9965000000000008

Number of H-Donors: 2

Number of H-Acceptors: 1

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information