loading...| Preferred Name |
nesiritide |
|
| Synonyms |
Human brain natriuretic peptide-32 nesiritide recombinant Brain natriuretic peptide-32 Human brain natriuretic factor-32 Natriuretic peptide type-B |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_135919 |
|
| charge |
0 |
|
| database_cross_reference |
CAS:124584-08-3 Drug_Central:1901 |
|
| formula |
C143H244N50O42S4 |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
Human brain natriuretic peptide-32 nesiritide recombinant Brain natriuretic peptide-32 Human brain natriuretic factor-32 Natriuretic peptide type-B |
|
| id |
CHEBI:135919 |
|
| in_subset | ||
| inchi |
InChI=1S/C143H244N50O42S4/c1-13-76(10)112-137(232)189-99(68-199)131(226)188-98(67-198)130(225)187-97(66-197)129(224)186-96(65-196)117(212)166-59-105(202)169-90(52-72(2)3)114(209)163-61-107(204)171-100(132(227)177-83(32-19-22-44-146)124(219)190-111(75(8)9)136(231)184-91(53-73(4)5)127(222)175-84(34-24-46-159-141(151)152)121(216)174-85(35-25-47-160-142(153)154)122(217)185-94(139(234)235)55-78-57-157-71-167-78)69-238-239-70-101(172-108(205)62-165-116(211)95(64-195)170-106(203)60-162-113(208)87(38-39-103(148)200)181-135(230)110(74(6)7)191-126(221)89(41-51-237-12)179-120(215)82(31-18-21-43-145)180-134(229)102-37-27-49-193(102)138(233)79(147)63-194)133(228)182-92(54-77-28-15-14-16-29-77)115(210)164-58-104(201)168-80(33-23-45-158-140(149)150)118(213)173-81(30-17-20-42-144)119(214)178-88(40-50-236-11)123(218)183-93(56-109(206)207)128(223)176-86(125(220)192-112)36-26-48-161-143(155)156/h14-16,28-29,57,71-76,79-102,110-112,194-199H,13,17-27,30-56,58-70,144-147H2,1-12H3,(H2,148,200)(H,157,167)(H,162,208)(H,163,209)(H,164,210)(H,165,211)(H,166,212)(H,168,201)(H,169,202)(H,170,203)(H,171,204)(H,172,205)(H,173,213)(H,174,216)(H,175,222)(H,176,223)(H,177,227)(H,178,214)(H,179,215)(H,180,229)(H,181,230)(H,182,228)(H,183,218)(H,184,231)(H,185,217)(H,186,224)(H,187,225)(H,188,226)(H,189,232)(H,190,219)(H,191,221)(H,192,220)(H,206,207)(H,234,235)(H4,149,150,158)(H4,151,152,159)(H4,153,154,160)(H4,155,156,161)/t76-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,110-,111-,112-/m0/s1 |
|
| inchikey |
HPNRHPKXQZSDFX-OAQDCNSJSA-N |
|
| label |
nesiritide |
|
| mass |
3464.047 |
|
| monoisotopicmass |
3461.73771 |
|
| notation |
CHEBI:135919 |
|
| prefLabel |
nesiritide |
|
| smiles |
[H]N[C@@H](CO)C(N1CCC[C@H]1C(N[C@@H](CCCCN)C(N[C@@H](CCSC)C(N[C@@H](C(C)C)C(N[C@@H](CCC(N)=O)C(NCC(N[C@@H](CO)C(NCC(N[C@H]2CSSC[C@H](NC(CNC([C@H](CC(C)C)NC(CNC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@H]([C@H](CC)C)NC([C@@H](NC([C@@H](NC([C@H](CCSC)NC([C@H](CCCCN)NC([C@@H](NC(CNC([C@@H](NC2=O)CC3=CC=CC=C3)=O)=O)CCCNC(N)=N)=O)=O)=O)CC(O)=O)=O)CCCNC(N)=N)=O)=O)CO)=O)CO)=O)CO)=O)CO)=O)=O)=O)=O)C(N[C@@H](CCCCN)C(N[C@@H](C(C)C)C(N[C@@H](CC(C)C)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CC4=CNC=N4)C(O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O |
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| treeView | ||
| subClassOf |