aspergilloid B

AlkaPlorer ID: AK015483

Synonym: None

IUPAC Name: None

Structure

SMILES: CC(O[C@@H](C(C)C)C(N1[C@H](C2)C(O[C@]32[C@H](N4O)N(C([C@@H]4C(C)C)=O)C5=CC=CC=C35)=O)=NC6=CC=CC=C6C1=O)=O

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InChI: InChI=1S/C30H32N4O7/c1-15(2)23-27(37)33-21-13-9-7-11-19(21)30(29(33)34(23)39)14-22(28(38)41-30)32-25(24(16(3)4)40-17(5)35)31-20-12-8-6-10-18(20)26(32)36/h6-13,15-16,22-24,29,39H,14H2,1-5H3/t22-,23+,24+,29+,30+/m1/s1

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InChIKey: DKJBEGRXQNYZIC-YAFXLJHTSA-N

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Source

Properties Information

Molecule Weight: 560.6070000000002

TPSA: 131.27

MolLogP: 3.442300000000002

Number of H-Donors: 1

Number of H-Acceptors: 10

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information