Acybolins; Acybolin B, 5-Deoxy, 1A-glycyl analogue 

AlkaPlorer ID: AK283260

Synonym: Acybolin D

IUPAC Name: None

Structure

SMILES: CCCCCCCC(O)CC(=O)NCC(=O)NC(C)C(=O)NC(C)C(=O)NCC(=O)NC1C2CC(O)CC(O)=C2C(=O)OC1(C)C(Cl)Cl

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InChI: InChI=1S/C31H49Cl2N5O10/c1-5-6-7-8-9-10-18(39)13-22(42)34-14-23(43)36-17(3)28(46)37-16(2)27(45)35-15-24(44)38-26-20-11-19(40)12-21(41)25(20)29(47)48-31(26,4)30(32)33/h16-20,26,30,39-41H,5-15H2,1-4H3,(H,34,42)(H,35,45)(H,36,43)(H,37,46)(H,38,44)

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InChIKey: OWQDZXCRVNGTNF-UHFFFAOYSA-N

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Reference

CAS: 1962998-04-4

Properties Information

Molecule Weight: 722.6640000000001

TPSA: 232.48999999999995

MolLogP: 0.5267000000000055

Number of H-Donors: 8

Number of H-Acceptors: 10

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information