Buxamine E

AlkaPlorer ID: AK015544

Synonym: '', 'Buxamine E'

IUPAC Name: None

Structure

SMILES: C[C@H]([NH3+])[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4C(=CC3=CC[C@]12C)CC[C@H]([NH+](C)C)C4(C)C

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InChI: InChI=1S/C26H44N2/c1-17(27)20-13-15-26(5)22-10-9-21-18(16-19(22)12-14-25(20,26)4)8-11-23(28(6)7)24(21,2)3/h12,16-17,20-23H,8-11,13-15,27H2,1-7H3/p+2/t17-,20+,21+,22+,23-,25+,26-/m0/s1

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InChIKey: UVGUDMTZIJXYDY-XSWJKVCQSA-P

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Properties Information

Molecule Weight: 386.6680000000002

TPSA: 32.08

MolLogP: 3.6552000000000016

Number of H-Donors: 2

Number of H-Acceptors: 0

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information