Source:http://linkedlifedata.com/resource/chembl/compound/1071498
| Predicate | Object |
|---|---|
| rdf:type | |
| chemicalCompound:standardIn... |
InChI=1S/C145H229N39O34/c1-15-81(10)114(137(211)174-107(73-186)132(206)176-109(75-188)143(217)218)179-134(208)111-54-37-61-183(111)141(215)98(50-30-34-58-149)165-125(199)99(63-77(2)3)166-118(192)82(11)160-138(212)115(83(12)189)182-130(204)105(69-90-71-155-76-159-90)170-128(202)103(67-88-43-23-18-24-44-88)171-136(210)113(80(8)9)178-140(214)117(85(14)191)181-123(197)97(52-36-60-157-145(153)154)164-135(209)112(79(6)7)177-133(207)110-53-38-62-184(110)142(216)108(74-187)175-121(195)95(49-29-33-57-148)161-126(200)102(66-87-41-21-17-22-42-87)172-139(213)116(84(13)190)180-122(196)96(51-35-59-156-144(151)152)163-124(198)100(64-78(4)5)168-127(201)101(65-86-39-19-16-20-40-86)169-131(205)106(72-185)173-120(194)94(48-28-32-56-147)162-129(203)104(167-119(193)92(150)46-27-31-55-146)68-89-70-158-93-47-26-25-45-91(89)93/h16-26,39-45,47,70-71,76-85,92,94-117,158,185-191H,15,27-38,46,48-69,72-75,146-150H2,1-14H3,(H,155,159)(H,160,212)(H,161,200)(H,162,203)(H,163,198)(H,164,209)(H,165,199)(H,166,192)(H,167,193)(H,168,201)(H,169,205)(H,170,202)(H,171,210)(H,172,213)(H,173,194)(H,174,211)(H,175,195)(H,176,206)(H,177,207)(H,178,214)(H,179,208)(H,180,196)(H,181,197)(H,182,204)(H,217,218)(H4,151,152,156)(H4,153,154,157)/t81-,82-,83+,84+,85+,92-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-/m0/s1
|
| chemicalCompound:standardIn... |
XMZFMJLJZBXEQY-AIGVPEBASA-N
|
| chemicalCompound:canonicalS... |
CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](NC(=O)[C@@H]4CCCN4C(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc5ccccc5)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc6ccccc6)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc7c[nH]c8ccccc78)NC(=O)[C@@H](N)CCCCN)[C@@H](C)O)C(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O
|
| chemicalCompound:molecularF... |
C145H229N39O34
|
| chemicalCompound:moleculeId |
1071498
|
| chemicalCompound:mwFreebase |
3062.61
|
| chemicalCompound:fullMwt |
3062.61
|
| chemicalCompound:chemblId |
CHEMBL1673353
|
| 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 |