Bromosalinosporamide

AlkaPlorer ID: AK029715

Synonym: '', 'Bromosalinosporamide'

IUPAC Name: (1S,4R,5S)-4-(2-bromoethyl)-1-[(S)-[(1S)-cyclohex-2-en-1-yl]-hydroxymethyl]-5-methyl-6-oxa-2-azabicyclo[3.2.0]heptane-3,7-dione

Structure

SMILES: C[C@@]12OC(=O)[C@@]1([C@@H](O)[C@@H]1C=CCCC1)N=C(O)[C@@H]2CCBr

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InChI: InChI=1S/C15H20BrNO4/c1-14-10(7-8-16)12(19)17-15(14,13(20)21-14)11(18)9-5-3-2-4-6-9/h3,5,9-11,18H,2,4,6-8H2,1H3,(H,17,19)/t9-,10+,11+,14+,15-/m1/s1

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InChIKey: UPZYHLMZJCVNAY-YRRINSJYSA-N

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Source

Properties Information

Molecule Weight: 358.232

TPSA: 79.12

MolLogP: 2.1292

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information