3D Mol Similar

UROCORTIN (RAT)

CAS No.: 171543-83-2

Molecular Weight：4707.26

Modify Date.: 2022-11-10 22:33

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1. Names and Identifiers

1.1 Name: UROCORTIN (RAT)
1.2 Synonyms: H-ASP-ASP-PRO-PRO-LEU-SER-ILE-ASP-LEU-THR-PHE-HIS-LEU-LEU-ARG-THR-LEU-LEU-GLU-LEU-ALA-ARG-THR-GLN-SER-GLN-ARG-GLU-ARG-ALA-GLU-GLN-ASN-ARG-ILE-ILE-PHE-ASP-SER-VAL-NH2 UROCORTIN (RAT) UROCORTIN (RAT) (FREE ACID) UROCORTIN (RAT) (MOUSE) Urocortin (sheep) Urocortin 1 (rat) Urocortin ratUrocortin

1.3 CAS No.: 171543-83-2

1.4 CID: 137699472

1.5 Molecular Formula: C206H338N62O64 (isomer)

1.6 Inchi: InChI=1S/C206H338N62O64.C2HF3O2/c1-28-102(20)156(262-192(323)141(92-271)258-182(313)129(78-98(12)13)251-193(324)142-53-42-72-267(142)201(332)143-54-43-73-268(143)200(331)138(88-154(291)292)256-165(296)113(207)84-151(285)286)194(325)255-137(87-153(289)290)187(318)247-131(80-100(16)17)189(320)266-161(109(27)274)199(330)254-133(82-111-46-35-32-36-47-111)183(314)248-134(83-112-89-223-93-229-112)185(316)246-128(77-97(10)11)180(311)244-126(75-95(6)7)178(309)236-118(52-41-71-228-206(221)222)176(307)265-160(108(26)273)198(329)252-130(79-99(14)15)181(312)245-127(76-96(8)9)179(310)240-124(60-66-150(283)284)172(303)243-125(74-94(4)5)177(308)231-106(24)163(294)232-116(50-39-69-226-204(217)218)175(306)264-159(107(25)272)197(328)242-121(57-63-146(210)277)173(304)257-139(90-269)190(321)241-119(55-61-144(208)275)168(299)235-115(49-38-68-225-203(215)216)167(298)239-123(59-65-149(281)282)170(301)234-114(48-37-67-224-202(213)214)166(297)230-105(23)164(295)233-122(58-64-148(279)280)169(300)238-120(56-62-145(209)276)171(302)249-135(85-147(211)278)186(317)237-117(51-40-70-227-205(219)220)174(305)261-158(104(22)30-3)196(327)263-157(103(21)29-2)195(326)253-132(81-110-44-33-31-34-45-110)184(315)250-136(86-152(287)288)188(319)259-140(91-270)191(322)260-155(101(18)19)162(212)293;3-2(4,5)1(6)7/h31-36,44-47,89,93-109,113-143,155-161,269-274H,28-30,37-43,48-88,90-92,207H2,1-27H3,(H2,208,275)(H2,209,276)(H2,210,277)(H2,211,278)(H2,212,293)(H,223,229)(H,230,297)(H,231,308)(H,232,294)(H,233,295)(H,234,301)(H,235,299)(H,236,309)(H,237,317)(H,238,300)(H,239,298)(H,240,310)(H,241,321)(H,242,328)(H,243,303)(H,244,311)(H,245,312)(H,246,316)(H,247,318)(H,248,314)(H,249,302)(H,250,315)(H,251,324)(H,252,329)(H,253,326)(H,254,330)(H,255,325)(H,256,296)(H,257,304)(H,258,313)(H,259,319)(H,260,322)(H,261,305)(H,262,323)(H,263,327)(H,264,306)(H,265,307)(H,266,320)(H,279,280)(H,281,282)(H,283,284)(H,285,286)(H,287,288)(H,289,290)(H,291,292)(H4,213,214,224)(H4,215,216,225)(H4,217,218,226)(H4,219,220,227)(H4,221,222,228);(H,6,7)/t102-,103-,104-,105-,106-,107+,108+,109+,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,155-,156-,157-,158-,159-,160-,161-;/m0./s1

1.7 InChkey: BTOGVDGOXGIAEB-FJAJBMFWSA-N

1.8 Canonical Smiles: NC(=N)NCCC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)

1.9 Isomers Smiles: NC(=N)NCCC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)

2. Properties

2.1 Solubility: 1% acetic acid: >1?mg/mL, clear, colorless

2.2 Appearance: Powder

2.3 Storage: Store at -20°C.

2.4 Water Solubility: 1% acetic acid: >1 mg/mL, clear, colorless

2.5 StorageTemp: −20°C

3. Safety and Handling

3.1 WGK Germany: 3

4. Computational chemical data

Molecular Weight: 4707.26g/mol
Molecular Formula: C₂₀₆H₃₃₈N₆₂O₆₄
Compound Is Canonicalized: True
XLogP3-AA:
Exact Mass: 4820.5095581
Monoisotopic Mass: 4818.5028484
Complexity: 11800
Rotatable Bond Count: 163
Hydrogen Bond Donor Count: 73
Hydrogen Bond Acceptor Count: 76
Topological Polar Surface Area: 2120
Heavy Atom Count: 339
Defined Atom Stereocenter Count: 46
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 2
CACTVS Substructure Key Fingerprint: AAADcfB//4AAAAAAAAAAAAAAAAAAAWLFgAAwYAAAAAAAAAAB0AAAHwAQCAAADTzhnhY/mJfJkgCoAzX3fAACgC2xEqAJ2YG4cIiKeD7A2TGUYAAutgLYyCe/n4KOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

5. Recommended Suppliers

Global15SuppliersView all >>

Hui Chem Company Limited Audited Suppliers

Products:API, Pharmaceutical intermediates, photoelectronic Materials
Tel:86-21-60542966

Urocortin, Rat

Purity:99%Packing: 200kg/bag FOB
Price: 1 USD/gram
Time: 2017/06/28

Inquire

Beijing HuameiHuli Biochem Ltd Audited Suppliers

Tel:010-86181995

Urocortin(Rattus norvegicus) (9CI)

Purity:99%Packing: 200kg/bag FOB
Price:
Time: 2010/12/18

Inquire

GL Biochem(Shanghai) Ltd

Products:custom peptides, catalogue peptides, pharmaceutical peptides, cosmetic peptides,monoclonal antibody, polyclonal antibody,FMOC-ARG(PBF)-OH,FMOC-LYS(ME.BOC)-OH
Tel:86-21-61263452

Urocortin (rat) (free acid)