| Predicate | Object |
|---|---|
| rdf:type | |
| chemicalCompound:standardIn... |
InChI=1S/C149H253N49O43S2/c1-21-25-32-84(177-132(227)94(42-49-111(206)207)186-138(233)100(59-73(11)12)193-145(240)114(74(13)14)196-134(229)95(43-50-112(208)209)184-128(223)89(37-31-55-167-149(161)162)181-144(239)105-67-243-242-66-83(151)122(217)188-102(61-82-64-164-69-169-82)140(235)191-99(58-72(9)10)139(234)195-105)123(218)170-77(17)118(213)174-87(35-29-53-165-147(157)158)124(219)171-78(18)119(214)176-93(41-48-110(204)205)131(226)183-92(40-47-108(154)202)133(228)189-97(56-70(5)6)136(231)173-79(19)120(215)175-91(39-46-107(153)201)130(225)182-90(38-45-106(152)200)125(220)172-80(20)121(216)187-101(60-81-63-163-68-168-81)141(236)194-104(65-199)143(238)192-103(62-109(155)203)142(237)180-88(36-30-54-166-148(159)160)127(222)178-86(34-27-28-52-150)129(224)190-98(57-71(7)8)137(232)179-85(33-26-22-2)126(221)185-96(44-51-113(210)211)135(230)198-116(76(16)24-4)146(241)197-115(117(156)212)75(15)23-3/h63-64,68-80,83-105,114-116,199H,21-62,65-67,150-151H2,1-20H3,(H2,152,200)(H2,153,201)(H2,154,202)(H2,155,203)(H2,156,212)(H,163,168)(H,164,169)(H,170,218)(H,171,219)(H,172,220)(H,173,231)(H,174,213)(H,175,215)(H,176,214)(H,177,227)(H,178,222)(H,179,232)(H,180,237)(H,181,239)(H,182,225)(H,183,226)(H,184,223)(H,185,221)(H,186,233)(H,187,216)(H,188,217)(H,189,228)(H,190,224)(H,191,235)(H,192,238)(H,193,240)(H,194,236)(H,195,234)(H,196,229)(H,197,241)(H,198,230)(H,204,205)(H,206,207)(H,208,209)(H,210,211)(H4,157,158,165)(H4,159,160,166)(H4,161,162,167)/t75-,76-,77-,78-,79-,80-,83+,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,114-,115-,116-/m0/s1
|
| chemicalCompound:standardIn... |
CDVIHWJIKVRLHH-HXSZGBISSA-N
|
| chemicalCompound:canonicalS... |
CCCC[C@H](NC(=O)[C@H](CCC(=O)O)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]1CSSC[C@@H](N)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N[C@@H](CC(C)C)C(=O)N1)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc3c[nH]cn3)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCC)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)N
|
| chemicalCompound:molecularF... |
C149 H253 N49 O43 S2
|
| chemicalCompound:moleculeId |
48826
|
| chemicalCompound:mwFreebase |
3483.04
|
| chemicalCompound:fullMwt |
3483.04
|
| chemicalCompound:chemblId |
CHEMBL408724
|
| 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 |