Epi-aszonalenin B

AlkaPlorer ID: AK063128

Synonym: None

IUPAC Name: (2R,10S,12S)-10-(2-methylbut-3-en-2-yl)-13,21-dioxo-1,3,14-triazapentacyclo[10.9.0.02,10.04,9.015,20]henicosa-4,6,8,15,17,19-hexaene-3-carbaldehyde

Structure

SMILES: C=CC(C)(C)[C@]12C[C@H]3C(O)=NC4=CC=CC=C4C(=O)N3[C@H]1N(C=O)C1=CC=CC=C12

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InChI: InChI=1S/C24H23N3O3/c1-4-23(2,3)24-13-19-20(29)25-17-11-7-5-9-15(17)21(30)27(19)22(24)26(14-28)18-12-8-6-10-16(18)24/h4-12,14,19,22H,1,13H2,2-3H3,(H,25,29)/t19-,22+,24-/m0/s1

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InChIKey: IWRNQJRIMSPELQ-KWOQKUFVSA-N

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Source

Properties Information

Molecule Weight: 401.4660000000001

TPSA: 73.21000000000001

MolLogP: 3.955400000000002

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information