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CHEBI:190678 - HA Binder_17X-3

Default Structure
ChEBI IDCHEBI:190678
ChEBI NameHA Binder_17X-3
Stars
DefinitionHyaluronic acid binding peptide from 310 domains
SubmitterKyle
DownloadsMolfile
FormulaC149H281N42O37S
Net Charge+9
Average Mass3285.211
Monoisotopic Mass3283.10692
SMILES[H][C@@]12CSC(CCCCC(=O)[NH2+][C@@H](CCCC[NH3+])C(=O)N[C@H](C(=O)NC(CCCC[NH3+])C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCC[NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCC[NH3+])C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCC[NH3+])C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCC[NH3+])C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCC[NH3+])C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCC[NH3+])C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCC[NH3+])C(=O)[O-])C(C)C)[C@@H](C)CC)[C@@H](C)CC)C(C)C)C(C)O)C(C)C)[C@]1([H])NC(=O)N2
InChIInChI=1S/C149H272N42O37S/c1-22-84(17)118(189-139(217)103(71-80(9)10)181-144(222)117(83(15)16)187-147(225)120(88(21)194)190-123(201)87(20)163-124(202)90(45-27-36-60-151)173-142(220)115(81(11)12)185-132(210)89(44-26-35-59-150)165-114(199)54-25-24-53-109-121-108(76-229-109)184-149(228)191-121)145(223)174-95(50-32-41-65-156)128(206)179-105(73-113(162)198)138(216)169-92(47-29-38-62-153)126(204)171-97(55-57-110(159)195)130(208)166-94(49-31-40-64-155)129(207)182-106(74-192)140(218)170-93(48-30-39-63-154)127(205)178-104(72-112(161)197)134(212)164-86(19)122(200)176-100(68-77(3)4)135(213)168-91(46-28-37-61-152)125(203)172-98(56-58-111(160)196)131(209)167-96(51-33-42-66-157)133(211)188-119(85(18)23-2)146(224)186-116(82(13)14)143(221)180-102(70-79(7)8)136(214)177-101(69-78(5)6)137(215)183-107(75-193)141(219)175-99(148(226)227)52-34-43-67-158/h77-109,115-121,192-194H,22-76,150-158H2,1-21H3,(H2,159,195)(H2,160,196)(H2,161,197)(H2,162,198)(H,163,202)(H,164,212)(H,165,199)(H,166,208)(H,167,209)(H,168,213)(H,169,216)(H,170,218)(H,171,204)(H,172,203)(H,173,220)(H,174,223)(H,175,219)(H,176,200)(H,177,214)(H,178,205)(H,179,206)(H,180,221)(H,181,222)(H,182,207)(H,183,215)(H,185,210)(H,186,224)(H,187,225)(H,188,211)(H,189,217)(H,190,201)(H,226,227)(H2,184,191,228)/p+9/t84-,85-,86-,87-,88?,89-,90?,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108+,109?,115-,116-,117-,118-,119-,120-,121+/m0/s1
InChIKeyILXGUMSZGPIUDH-HPBVVAHCSA-W
ChEBI Ontology
Outgoing Relation(s)
HA Binder_17X-3 (CHEBI:190678) is a organic molecular entity (CHEBI:50860)