Nesiritide（CAS号：124584-08-3）

人脑利钠肽

基本信息

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CAS号

124584-08-3

分子式

C143H244N50O42S4

分子量

3464 g/mol

化学分类

基础化工原料有机化学品羧酸类

基础化工原料有机化学品胺类

基础化工原料有机化学品杂环化合物

医药化工医药中间体杂环中间体

精细化工产品染料和颜料有机染料

精细化工产品表面活性剂阴离子表面活性剂

实验室化学品科研化学品生化试剂

基本物理性质

水溶性

Soluble in water at 1mg/ml

SMILES

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CCC(C)C1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NCC(=O)NC(CSSCC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCNC(=N)N)CC(=O)O)CCSC)CCCCN)CCCNC(=N)N)CC2=CC=CC=C2)NC(=O)CNC(=O)C(CO)NC(=O)CNC(=O)C(CCC(=O)N)NC(=O)C(C(C)C)NC(=O)C(CCSC)NC(=O)C(CCCCN)NC(=O)C3CCCN3C(=O)C(CO)N)C(=O)NC(CCCCN)C(=O)NC(C(C)C)C(=O)NC(CC(C)C)C(=O)NC(CCCNC(=N)N)C(=O)NC(CCCNC(=N)N)C(=O)NC(CC4=CNC=N4)C(=O)O)CC(C)C)CO)CO)CO)CO

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

LogP

-20.215620000000182

拓扑极性表面积

1512.7399999999993 Å²

氢键供体/受体

65 / 92

复杂度

7750

同义词与引用数据

英文

CHEBI:135919
AKOS024457660
124584-08-3
BNP-32 (human)
NS00014349
Brain Natriuretic Peptide-32 human, >=97% (HPLC), powder
F85459
Nesiritide
Brain natriuretic peptide (1-32) (human)
Biotinyl-BNP-32 (human), Biotinyl-Brain Natriuretic Peptide-32 (human), Biotinyl-Nesiritide
BNP-32 (human), Brain Natriuretic Peptide-32 (human), Nesiritide
NESIRITIDE
1,2-Dithia-5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50-hexadecaazacyclotripentacontane,cyclic peptide deriv.
1: PN: US6028055 SEQID: 1 claimed protein
BNP-32
Brain Natriuretic Peptide-32 human
Human brain natriuretic factor-32
Human brain natriuretic peptide-32
L-Histidine,L-seryl-L-prolyl-L-lysyl-L-methionyl-L-valyl-L-glutaminylg
Natriureticfactor-32 (human brain clone lhBNP57)
Natriuretic peptide type-B
BNP HUMAN
BNP-32 (HUMAN)
BNP (1-32), HUMAN
Nesiritide (BNP-32)
Nesiritide [USAN:INN]
BRAIN NATRIURETIC PEPTIDE, HUMAN
BRAIN NATRIURETIC PEPTIDE-32 (HUMAN)
BRAIN NATRIURETIC PEPTIDE (1-32), HUMAN
BRAIN(B-TYPE) NATRIURETIC PEPTIDE-32 (HUMAN)