Eurystatin B

AlkaPlorer ID: AK034992

Synonym: 'Eurystatin B', 'Bu 4164E-B'

IUPAC Name: (E,6S)-6-methyl-N-[(3R,7S,10S)-7-methyl-3-(2-methylpropyl)-2,5,6,9-tetraoxo-1,4,8-triazacyclotridec-10-yl]oct-2-enamide

Structure

SMILES: CC[C@H](C)CC/C=C/C(O)=N[C@H]1CCCN=C(O)[C@@H](CC(C)C)NC(=O)C(=O)[C@H](C)N=C1O

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InChI: InChI=1S/C24H40N4O5/c1-6-16(4)10-7-8-12-20(29)27-18-11-9-13-25-22(31)19(14-15(2)3)28-24(33)21(30)17(5)26-23(18)32/h8,12,15-19H,6-7,9-11,13-14H2,1-5H3,(H,25,31)(H,26,32)(H,27,29)(H,28,33)/b12-8+/t16-,17-,18-,19+/m0/s1

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InChIKey: YNIGBMUXBCZRNQ-GREMHARRSA-N

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Properties Information

Molecule Weight: 464.6070000000002

TPSA: 143.94

MolLogP: 3.889300000000002

Number of H-Donors: 4

Number of H-Acceptors: 5

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information