7-Amino-1(14),15-neoamphilectadiene; Isocyanide

AlkaPlorer ID: AK286558

Synonym: 7-Isocyano-1(14),15-neoamphilectadiene

IUPAC Name: None

Structure

SMILES: [C-]#[N+]C1(C)CCC2C(C)CC3(/C=C/C(=C)C)C(C)CCC1C23

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InChI: InChI=1S/C21H31N/c1-14(2)9-12-21-13-15(3)17-10-11-20(5,22-6)18(19(17)21)8-7-16(21)4/h9,12,15-19H,1,7-8,10-11,13H2,2-5H3/b12-9+

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InChIKey: SMTVJJYBXOUWTB-FMIVXFBMSA-N

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Reference

CAS: 175861-88-8

Properties Information

Molecule Weight: 297.486

TPSA: 4.36

MolLogP: 5.895190000000007

Number of H-Donors: 0

Number of H-Acceptors: 0

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information