| Predicate | Object |
|---|---|
| rdf:type | |
| chemicalCompound:standardIn... |
InChI=1S/C85H109ClN18O17/c1-8-15-71(106)93-63(43-54-21-28-56-17-9-10-18-57(56)39-54)76(111)96-64(40-51-22-29-58(86)30-23-51)78(113)98-67(44-55-16-13-35-88-46-55)80(115)100-69(47-105)81(116)99-66(42-52-24-31-59(32-25-52)91-74(109)68-45-72(107)102-84(119)101-68)79(114)97-65(41-53-26-33-60(34-27-53)92-85(120)103-121-7)77(112)95-62(38-48(2)3)75(110)94-61(19-11-12-36-89-49(4)5)83(118)104-37-14-20-70(104)82(117)90-50(6)73(87)108/h9-10,13,16-18,21-35,39,46,48-50,61-70,89,105H,8,11-12,14-15,19-20,36-38,40-45,47H2,1-7H3,(H2,87,108)(H,90,117)(H,91,109)(H,93,106)(H,94,110)(H,95,112)(H,96,111)(H,97,114)(H,98,113)(H,99,116)(H,100,115)(H2,92,103,120)(H2,101,102,107,119)/t50-,61+,62+,63-,64-,65-,66+,67-,68+,69+,70+/m1/s1
|
| chemicalCompound:standardIn... |
NBEMAYGXGAFXLU-BNPSKOLKSA-N
|
| chemicalCompound:canonicalS... |
CCCC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)N[C@H](Cc3ccc(Cl)cc3)C(=O)N[C@H](Cc4cccnc4)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc5ccc(NC(=O)[C@@H]6CC(=O)NC(=O)N6)cc5)C(=O)N[C@H](Cc7ccc(NC(=O)NOC)cc7)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC(C)C)C(=O)N8CCC[C@H]8C(=O)N[C@H](C)C(=O)N
|
| chemicalCompound:molecularF... |
C85 H109 Cl N18 O17
|
| chemicalCompound:moleculeId |
348576
|
| chemicalCompound:mwFreebase |
1690.34
|
| chemicalCompound:fullMwt |
1690.34
|
| chemicalCompound:chemblId |
CHEMBL264781
|
| chemicalCompound:maxPhase |
0
|
| chemicalCompound:therapeuti... |
0
|
| chemicalCompound:dosedIngre... |
No
|
| chemicalCompound:structureT... | |
| chemicalCompound:chebi | |
| chemicalCompound:moleculeTy... | |
| chemicalCompound:oral |
No
|
| chemicalCompound:parenteral |
No
|
| chemicalCompound:topical |
No
|
| chemicalCompound:blackBoxWa... |
No
|
| chemicalCompound:naturalPro... |
No
|
| chemicalCompound:proDrug |
No
|
| chemicalCompound:activity |