Source:http://linkedlifedata.com/resource/chembl/compound/1249656
| Predicate | Object |
|---|---|
| rdf:type | |
| chemicalCompound:standardIn... |
InChI=1S/C80H93Cl3N10O26/c1-31(2)18-45(86-7)71(104)92-61-63(99)35-13-16-49(43(82)20-35)114-51-22-38-23-52(67(51)119-78-68(65(101)64(100)53(30-94)116-78)118-56-28-80(6,70(103)33(4)113-56)87-29-37-10-8-9-11-42(37)81)115-50-17-14-36(21-44(50)83)66(117-55-27-79(5,85)69(102)32(3)112-55)62-76(109)91-60(77(110)111)41-24-39(95)25-48(97)57(41)40-19-34(12-15-47(40)96)58(73(106)93-62)90-74(107)59(38)89-72(105)46(26-54(84)98)88-75(61)108/h8-17,19-25,31-33,45-46,53,55-56,58-66,68-70,78,86-87,94-97,99-103H,18,26-30,85H2,1-7H3,(H2,84,98)(H,88,108)(H,89,105)(H,90,107)(H,91,109)(H,92,104)(H,93,106)(H,110,111)/t32-,33-,45+,46-,53+,55-,56-,58+,59+,60+,61+,62-,63+,64+,65-,66+,68+,69+,70+,78-,79-,80-/m0/s1
|
| chemicalCompound:standardIn... |
STTWTRUGKNCCSM-GDUMQMLCSA-N
|
| chemicalCompound:canonicalS... |
CN[C@H](CC(C)C)C(=O)N[C@@H]1[C@H](O)c2ccc(Oc3cc4cc(Oc5ccc(cc5Cl)[C@@H](O[C@H]6C[C@](C)(N)[C@H](O)[C@H](C)O6)[C@@H]7NC(=O)[C@H](NC(=O)[C@@H]4NC(=O)[C@H](CC(=O)N)NC1=O)c8ccc(O)c(c8)c9c(O)cc(O)cc9[C@@H](NC7=O)C(=O)O)c3O[C@@H]%10O[C@H](CO)[C@@H](O)[C@H](O)[C@H]%10O[C@H]%11C[C@](C)(NCc%12ccccc%12Cl)[C@H](O)[C@H](C)O%11)c(Cl)c2
|
| chemicalCompound:molecularF... |
C80H93Cl3N10O26
|
| chemicalCompound:moleculeId |
1249656
|
| chemicalCompound:mwFreebase |
1717
|
| chemicalCompound:fullMwt |
1717
|
| chemicalCompound:chemblId |
CHEMBL1910066
|
| 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 |