| Predicate | Object |
|---|---|
| rdf:type | |
| chemicalCompound:standardIn... |
InChI=1S/C158H261N47O43/c1-23-27-40-93-134(226)178-88(22)132(224)202-118(201-120(212)71-112(153(245)183-93)198-149(241)108(66-81(13)14)199-155(247)124(82(15)16)203-143(235)102(51-57-122(215)216)189-138(230)97(44-37-61-173-158(168)169)185-147(239)106(64-79(9)10)195-148(240)107(65-80(11)12)196-150(242)110(69-91-73-171-76-175-91)192-133(225)92(160)67-89-38-30-29-31-39-89)45-32-33-46-119(211)176-85(19)129(221)181-101(50-56-121(213)214)141(233)188-100(49-55-116(163)209)142(234)193-104(62-77(5)6)145(237)179-86(20)130(222)180-99(48-54-115(162)208)140(232)187-98(47-53-114(161)207)135(227)177-87(21)131(223)191-109(68-90-72-170-75-174-90)151(243)200-113(74-206)154(246)197-111(70-117(164)210)152(244)186-96(43-36-60-172-157(166)167)137(229)182-95(42-34-35-59-159)139(231)194-105(63-78(7)8)146(238)184-94(41-28-24-2)136(228)190-103(52-58-123(217)218)144(236)205-126(84(18)26-4)156(248)204-125(83(17)25-3)127(219)128(165)220/h29-31,38-39,72-73,75-88,92-113,118,124-126,206H,23-28,32-37,40-71,74,159-160H2,1-22H3,(H2,161,207)(H2,162,208)(H2,163,209)(H2,164,210)(H2,165,220)(H,170,174)(H,171,175)(H,176,211)(H,177,227)(H,178,226)(H,179,237)(H,180,222)(H,181,221)(H,182,229)(H,183,245)(H,184,238)(H,185,239)(H,186,244)(H,187,232)(H,188,233)(H,189,230)(H,190,228)(H,191,223)(H,192,225)(H,193,234)(H,194,231)(H,195,240)(H,196,242)(H,197,246)(H,198,241)(H,199,247)(H,200,243)(H,201,212)(H,202,224)(H,203,235)(H,204,248)(H,205,236)(H,213,214)(H,215,216)(H,217,218)(H4,166,167,172)(H4,168,169,173)/t83-,84-,85-,86-,87-,88-,92+,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112+,113-,118?,124-,125-,126-/m0/s1
|
| chemicalCompound:standardIn... |
HXLZPWWKUHTAMW-DGNUVZKPSA-N
|
| chemicalCompound:canonicalS... |
CCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)CCCCC2NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](N)Cc4ccccc4)C(C)C)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](C)C(=O)N2)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)C(=O)N
|
| chemicalCompound:molecularF... |
C158 H261 N47 O43
|
| chemicalCompound:moleculeId |
295783
|
| chemicalCompound:mwFreebase |
3507.05
|
| chemicalCompound:fullMwt |
3507.05
|
| chemicalCompound:chemblId |
CHEMBL439891
|
| 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 |