Dimerumic acid; N6,N6'-Dideoxy, 11-Ac 

AlkaPlorer ID: AK296533

Synonym: Trichocyclodipeptide B

IUPAC Name: None

Structure

SMILES: CC(=O)OCC/C(C)=C/C(=O)NCCCC1NC(=O)C(CCCNC(=O)/C=C(\C)CCO)NC1=O

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InChI: InChI=1S/C24H38N4O7/c1-16(8-12-29)14-21(31)25-10-4-6-19-23(33)28-20(24(34)27-19)7-5-11-26-22(32)15-17(2)9-13-35-18(3)30/h14-15,19-20,29H,4-13H2,1-3H3,(H,25,31)(H,26,32)(H,27,34)(H,28,33)/b16-14+,17-15+

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InChIKey: RZPDQEPMHAHTJR-YXLFCKQPSA-N

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Reference

CAS: 2170766-75-1

Source

Properties Information

Molecule Weight: 494.58900000000034

TPSA: 162.92999999999998

MolLogP: -0.0093999999999968

Number of H-Donors: 5

Number of H-Acceptors: 7

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information