Oxytocin,1-(3-mercaptopropanoic acid)-4-L-glutamic acid-8-L-lysine-, cyclic (4&reg | 125666-62-8

Oxytocin,1-(3-mercaptopropanoic acid)-4-L-glutamic acid-8-L-lysine-, cyclic (4&reg结构式图片|125666-62-8结构式图片

中文名称：Oxytocin,1-(3-mercaptopropanoic acid)-4-L-glutamic acid-8-L-lysine-, cyclic (4&reg
英文名称：Oxytocin,1-(3-mercaptopropanoic acid)-4-L-glutamic acid-8-L-lysine-, cyclic (4®8)-peptide (9CI)
CAS No.：125666-62-8 分子式：C₄₃H₆₃N₁₁O₁₂S₂ 分子量：990.156820000002
如需查看该化合物的详细结构式,mol文件,smile, InChi 请点击：Oxytocin,1-(3-mercaptopropanoic acid)-4-L-glutamic acid-8-L-lysine-, cyclic (4&reg结构式
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Oxytocin,1-(3-mercaptopropanoic acid)-4-L-glutamic acid-8-L-lysine-, cyclic (4&reg的其他展现形式

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名称和标识符

Inchi	InChI=1S/C43H63N11O12S2/c1-3-23(2)36-42(65)47-20-25-18-35(59)46-14-5-4-7-27(38(61)48-21-33(45)57)50-41(64)31-8-6-15-54(31)43(66)30(52-39(62)29(19-32(44)56)51-37(25)60)22-68-67-16-13-34(58)49-28(40(63)53-36)17-24-9-11-26(55)12-10-24/h9-12,23,25,27-31,36,55H,3-8,13-22H2,1-2H3,(H2,44,56)(H2,45,57)(H,46,59)(H,47,65)(H,48,61)(H,49,58)(H,50,64)(H,51,60)(H,52,62)(H,53,63)/t23-,25?,27-,28-,29-,30?,31?,36-/m0/s1
InChIKey	LFKZJWPKJWLCPZ-RROUQNFWSA-N
SMILES	NC(CNC([C@@H]1CCCCNC(=O)CC2CNC([C@@H](NC([C@H](CC3C=CC(O)=CC=3)NC(CCSSCC(NC([C@@H](NC2=O)CC(=O)N)=O)C(=O)N2CCCC2C(=O)N1)=O)=O)[C@H](CC)C)=O)=O)=O

别名信息

- 中文别名 -

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- 英文别名 -

Oxytocin,1-(3-mercaptopropanoic acid)-4-L-glutamic acid-8-L-lysine-, cyclic (4&reg 8)-peptide (9CI) Oxytocin, mpa(1)-cyclo(glu(4)-lys(8))- (3R,15S,18S,34S)-N,34-bis(2-amino-2-oxoethyl)-18-(4-hydroxybenzyl)-15-[(1S)-1-methylpropyl]-1,9,14,17,20,27,33,36-octaoxooctacosahydro-25H-26,11-(epiminoethanoiminomethano)pyrrolo[2,1-y][1,2,6,9,12,17,23 1-Mpa-cyclo(4-glu-8-lys)-oxytocin Oxytocin, 1-(3-mercaptopropanoic acid)-4-L-glutamic acid-8-L-lysine-, cyclic(4-8)-peptide Oxytocin, beta mercaptopropionic acid(1)-cyclo(glutamyl(4)-lysyl(8))-

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物化性质

计算特性

精确分子量

989.41039

实验特性

PSA

359.52

化合物详情（旧版）

SMILES

NC(=O)CNC(=O)[C@H]1NC(=O)C2N(CCC2)C(=O)C3NC(=O)[C@H](CC(N)=O)NC(=O)C(CC(=O)NCCCC1)CNC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@@H](NC(=O)CCSSC3)CC4=CC=C(O)C=C4