None

AlkaPlorer ID: AK319454

Synonym: None

IUPAC Name: None

Structure

SMILES: C=CC1=C(C)C2=CC3=NC(=C4C5=C(C(=O)[C@@H]4C(=O)OC)C(C)=C(C=C4N=C(C=C1N2)C(C)=C4CC)N5)[C@@H](CCC(=O)OC/C=C(\C)CCC[C@H](C)CC[C@H](O)[C@H](C)CCCC(C)C)[C@@H]3C

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InChI: InChI=1S/C55H74N4O6/c1-13-38-34(8)41-27-43-36(10)40(22-24-48(61)65-26-25-32(6)19-16-18-31(5)21-23-47(60)33(7)20-15-17-30(3)4)52(58-43)50-51(55(63)64-12)54(62)49-37(11)44(59-53(49)50)29-46-39(14-2)35(9)42(57-46)28-45(38)56-41/h13,25,27-31,33,36,40,47,51,56,59-60H,1,14-24,26H2,2-12H3/b32-25+,41-27?,42-28?,43-27?,44-29?,45-28?,46-29?,52-50?/t31-,33+,36-,40-,47-,51+/m0/s1

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InChIKey: OPKOPMUPDBELTF-HAHVTKRDSA-N

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Reference

Properties Information

Molecule Weight: 887.2189999999995

TPSA: 147.26

MolLogP: 12.935139999999976

Number of H-Donors: 3

Number of H-Acceptors: 8

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information