None

AlkaPlorer ID: AK319327

Synonym: None

IUPAC Name: None

Structure

SMILES: C=CC1=CC2=CC3=NC(=C4C5=NC(=CC6=C(CC)C(C)=C(C=C1N2)[N-]6)C(C)=C5C(=O)[C@@H]4C(=O)OC)[C@@H](CCC(=O)OC/C=C(\C)CCCCCCCCCCCCCCCC)[C@@H]3C

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InChI: InChI=1S/C54H72N4O5/c1-9-12-13-14-15-16-17-18-19-20-21-22-23-24-25-34(4)28-29-63-47(59)27-26-41-36(6)42-31-39-30-38(10-2)45(55-39)32-43-35(5)40(11-3)46(56-43)33-44-37(7)48-52(58-44)49(51(41)57-42)50(53(48)60)54(61)62-8/h10,28,30-33,36,41,50H,2,9,11-27,29H2,1,3-8H3,(H2,55,56,57,58,60)/p-1/b34-28+/t36-,41-,50+/m0/s1

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InChIKey: CCYKLRGQPZITDT-MHEBHAROSA-M

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Reference

Properties Information

Molecule Weight: 856.1849999999991

TPSA: 125.34000000000002

MolLogP: 13.256119999999976

Number of H-Donors: 1

Number of H-Acceptors: 7

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information