Source:http://linkedlifedata.com/resource/chembl/compound/1071499
| Predicate | Object |
|---|---|
| rdf:type | |
| chemicalCompound:synonym | |
| chemicalCompound:standardIn... |
InChI=1S/C108H165N39O20S4/c1-58(2)85(147-92(157)74(31-18-46-129-108(122)123)138-95(160)76(48-60-21-7-4-8-22-60)139-100(165)82(56-170)145-97(162)79(51-63-52-130-68-25-10-9-23-66(63)68)142-90(155)72(29-16-44-127-106(118)119)134-87(152)67(110)24-13-41-124-103(112)113)102(167)146-83(57-171)101(166)141-77(49-61-32-36-64(148)37-33-61)94(159)135-70(28-15-43-126-105(116)117)88(153)131-53-84(150)132-75(47-59-19-5-3-6-20-59)93(158)144-81(55-169)99(164)140-78(50-62-34-38-65(149)39-35-62)96(161)137-73(30-17-45-128-107(120)121)89(154)136-71(26-11-12-40-109)91(156)143-80(54-168)98(163)133-69(86(111)151)27-14-42-125-104(114)115/h3-10,19-23,25,32-39,52,58,67,69-83,85,130,148-149,168-171H,11-18,24,26-31,40-51,53-57,109-110H2,1-2H3,(H2,111,151)(H,131,153)(H,132,150)(H,133,163)(H,134,152)(H,135,159)(H,136,154)(H,137,161)(H,138,160)(H,139,165)(H,140,164)(H,141,166)(H,142,155)(H,143,156)(H,144,158)(H,145,162)(H,146,167)(H,147,157)(H4,112,113,124)(H4,114,115,125)(H4,116,117,126)(H4,118,119,127)(H4,120,121,128)(H4,122,123,129)/t67-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,85-/m0/s1
|
| chemicalCompound:standardIn... |
XLKIKNJYQPAKKM-MTHDQZMLSA-N
|
| chemicalCompound:canonicalS... |
CC(C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CS)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc4ccc(O)cc4)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](Cc5ccccc5)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc6ccc(O)cc6)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N
|
| chemicalCompound:molecularF... |
C108H165N39O20S4
|
| chemicalCompound:moleculeId |
1071499
|
| chemicalCompound:mwFreebase |
2457.98
|
| chemicalCompound:fullMwt |
2457.98
|
| chemicalCompound:chemblId |
CHEMBL1673354
|
| 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 |