Caprolactin B

AlkaPlorer ID: AK058009

Synonym: None

IUPAC Name: (6S)-6-methyl-N-[(3S)-2-oxoazepan-3-yl]octanamide

Structure

SMILES: CC[C@H](C)CCCCC(O)=N[C@H]1CCCCN=C1O

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InChI: InChI=1S/C15H28N2O2/c1-3-12(2)8-4-5-10-14(18)17-13-9-6-7-11-16-15(13)19/h12-13H,3-11H2,1-2H3,(H,16,19)(H,17,18)/t12-,13-/m0/s1

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InChIKey: KHXOPNKILPCHOZ-STQMWFEESA-N

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Reference

PubChem CID: 162983206

SuperNatural Ⅲ: SN0186098-02

NPASS: NPC237929

Properties Information

Molecule Weight: 268.40099999999995

TPSA: 65.18

MolLogP: 4.058400000000002

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information