Gliocladride B

AlkaPlorer ID: AK075501

Synonym: None

IUPAC Name: (3E,6S)-3-[[4-[(2E)-3,7-dimethylocta-2,6-dienoxy]phenyl]methylidene]-1-hydroxy-6-methylpiperazine-2,5-dione

Structure

SMILES: CC(C)=CCC/C(C)=C/COC1=CC=C(/C=C2/NC(=O)[C@H](C)N(O)C2=O)C=C1

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InChI: InChI=1S/C22H28N2O4/c1-15(2)6-5-7-16(3)12-13-28-19-10-8-18(9-11-19)14-20-22(26)24(27)17(4)21(25)23-20/h6,8-12,14,17,27H,5,7,13H2,1-4H3,(H,23,25)/b16-12+,20-14+/t17-/m0/s1

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InChIKey: FMVPWWRMFNNRRJ-MSODBRDKSA-N

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Reference

None

PubChem CID: 44517141

SuperNatural Ⅲ: SN0089934-03

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NPAtlas: NPA017734

Properties Information

Molecule Weight: 384.4760000000001

TPSA: 78.87

MolLogP: 3.8351000000000015

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information