Microtermolide B

AlkaPlorer ID: AK030358

Synonym: None

IUPAC Name: [(1R,2R)-2-methyl-1-[(3R)-2-oxooxolan-3-yl]pentyl] (2R)-2-[[(2S)-2-[[(E)-4-amino-4-oxobut-2-enoyl]amino]propanoyl]amino]-3-methylbutanoate

Structure

SMILES: CCC[C@@H](C)[C@@H](OC(=O)[C@H](N=C(O)[C@H](C)N=C(O)/C=C/C(=N)O)C(C)C)[C@H]1CCOC1=O

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InChI: InChI=1S/C22H35N3O7/c1-6-7-13(4)19(15-10-11-31-21(15)29)32-22(30)18(12(2)3)25-20(28)14(5)24-17(27)9-8-16(23)26/h8-9,12-15,18-19H,6-7,10-11H2,1-5H3,(H2,23,26)(H,24,27)(H,25,28)/b9-8+/t13-,14+,15-,18-,19-/m1/s1

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InChIKey: KFOVZWSWKKYISY-IFXYZXERSA-N

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Source

Properties Information

Molecule Weight: 453.5360000000002

TPSA: 161.86

MolLogP: 3.315070000000002

Number of H-Donors: 4

Number of H-Acceptors: 7

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information