Berkeleyamide B

AlkaPlorer ID: AK068633

Synonym: 'Berkeleyamide B'

IUPAC Name: [(R)-[5-(3-methylbutanoylcarbamoyl)-4-oxopyran-2-yl]-phenylmethyl] acetate

Structure

SMILES: CC(=O)O[C@H](C1=CC=CC=C1)C1=CC(=O)C(C(=O)N=C(O)CC(C)C)=CO1

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InChI: InChI=1S/C20H21NO6/c1-12(2)9-18(24)21-20(25)15-11-26-17(10-16(15)23)19(27-13(3)22)14-7-5-4-6-8-14/h4-8,10-12,19H,9H2,1-3H3,(H,21,24,25)/t19-/m1/s1

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InChIKey: VDFNZTMTSRBUGD-LJQANCHMSA-N

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Properties Information

Molecule Weight: 371.3890000000001

TPSA: 106.17000000000002

MolLogP: 3.435100000000002

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information