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醋酸奥曲肽 | 83150-76-9

醋酸奥曲肽
Octreotide
83150-76-9
C49H66N10O10S2
1019.2393488884
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:醋酸奥曲肽结构式
165412376
醋酸奥曲肽价格
简介
醋酸奥曲肽主要适合需要长期给药的肢端肥大症及一些消化道类癌、神经内分泌肿瘤。国内主要厂家上海柏际。
名称和标识符
MDL MFCD00871400
InChIKey DEQANNDTNATYII-OULOTJBUSA-N
Inchi 1S/C49H66N10O10S2/c1-28(61)39(25-60)56-48(68)41-27-71-70-26-40(57-43(63)34(51)21-30-13-5-3-6-14-30)47(67)54-37(22-31-15-7-4-8-16-31)45(65)55-38(23-32-24-52-35-18-10-9-17-33(32)35)46(66)53-36(19-11-12-20-50)44(64)59-42(29(2)62)49(69)58-41/h3-10,13-18,24,28-29,34,36-42,52,60-62H,11-12,19-23,25-27,50-51H2,1-2H3,(H,53,66)(H,54,67)(H,55,65)(H,56,68)(H,57,63)(H,58,69)(H,59,64)/t28-,29-,34-,36+,37+,38-,39-,40+,41+,42+/m1/s1
SMILES C([C@@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@H](O)C)C(=O)N[C@H](C(=O)N[C@H](CO)[C@H](O)C)CSSC[C@H](NC(=O)[C@H](N)CC2C=CC=CC=2)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N1)C1=CNC2C=CC=CC1=2
别名信息
- 中文别名 -
  • 醋酸奥曲肽
  • [R-(R^<*>^,R^<*>^)]-D-苯丙酰-L-半胱氨酰-L-苯丙酰-D-色胺酰-L-赖氨酰-1-苏氨酰-N-[2-羟基-1-(羟基甲基)丙基]-L-苏氨酰胺环(2→7)二硫化物
  • 醋酸奥曲肽 OCTREOTIDEACETATE
  • ▲醋酸奥曲肽
  • 奥曲肽
  • 奥曲肽标准品
  • 醋酸奥曲肽 Octreotide Acetate
  • [R-(R^^,R^^)]-D-苯丙酰-L-半胱氨酰-L-苯丙酰-D-色胺酰-L-赖氨酰-1-苏氨酰-N-[2-羟基-1-(羟基甲基)丙基]-L-苏氨酰胺环(2→7)二硫化物
  • [R-(R^<*>^,R^<*>^)]-D-苯丙酰-L-半胱氨酰-L-苯丙 酰-D-色胺酰-L-赖氨酰-1-苏氨酰-N-[2-羟基-1-(羟基甲基)丙基]-L-苏氨酰胺环(2 →7)二硫化
- 英文别名 -
  • Octreotide acetate
  • L-cysteinamide, D-phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L-threonyl-N-(2-hydroxy-1-(hydroxymethyl) propyl)-cyclic (2-&gt
  • 7)-disulfide, (R-(R*,R*))
  • Sandostatin
  • Sms 201-995
  • (4R,7S,10S,13R,16S,19R)-13-((1H-Indol-3-yl)methyl)-19-((R)-2-amino-3-phenylpropanamido)-10-(4-aminobutyl)-16-benzyl-N-(1,3-dihydroxybutan-2-yl)-7-((R)-1-hydrox
  • Octreotide
  • ctreotide
  • DARAMONOL
  • D-Phe-Cys(1)-Phe-D-Trp-Lys-Thr-Cys(1)-N-[(1R,2R)-1-(Hydroxymethyl)-2-hydroxypropyl]-NH2
  • H-D-Phe-Cys-Phe-D-Trp-Lys-Thr-Cys-L-threoninol acetate salt (Disulfide bond)
  • Longastatin
  • Ocetreotide,Acetate
  • OCTREOTIDE ACETATE (GMP)
  • Octreotode Acetate
  • OXTREOTIDE
  • Phe-c(Cys-Phe-Trp-Lys-Thr-Cys)-CH(CH2OH)-CH(OH)-CH3
  • Sandostatin<*>
  • [R-(R*,R*)]-D-Phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L-threonyl-N-[2-hydroxy-1-(hydroxy-methyl)propyl]-cysteinamide cyclic(2->7)-disulfide
  • 7)-disulfide
  • 1,2-Dithia-5,8,11,14,17-pentaazacycloeicosane, cyclic peptide deriv. (ZCI)
  • L-Cysteinamide, D-phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L-threonyl-N-[2-hydroxy-1-(hydroxymethyl)propyl]-, cyclic (2→7)-disulfide, [R-(R*,R*)]- (ZCI)
  • 11: PN: US20030229017 PAGE: 13 claimed protein
  • 14: PN: DE10147056 PAGE: 40 claimed protein
  • 17: PN: US6268342 SEQID: 18 claimed protein
  • 1: PN: EP1118336 SEQID: 1 claimed protein
  • 1: PN: WO2005007122 TABLE: 22 claimed protein
  • 1: PN: WO2014116144 PAGE: 4 claimed sequence
  • 25: PN: WO2007081792 SEQID: 40 claimed protein
  • 2: PN: EP1358890 TABLE: A claimed protein
  • CAM 2029
  • MeSH ID: D015282
  • Sanostatine
  • SMS 201-995
  • 83150-76-9 (free base)
  • AC-28733
  • 83150-76-9
  • D-Phenylalanyl-L-cysteinyl-L-phenyl-alanyl-D-tryptophyl-L-lysyl-L-threonyl-N-(2-hydroxy-1-(hydroxymethyl)propyl)-L-cysteinamide Cyclic (2->7)-Disulfide
  • CCG-270610
  • MFCD00871400
  • DTXCID6028608
  • Octreotide, >=98% (HPLC)
  • BDBM50272772
  • UNII-RWM8CCW8GP
  • OCTREOTIDE [EP MONOGRAPH]
  • Q419935
  • D-Phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L-threonyl-L-cysteinyl-L-threoninol cyclic (2-7)-disulfide
  • (4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-19-[[(2R)-2-amino-3-phenylpropanoyl]amino]-16-benzyl-N-[(2R,3R)-1,3-dihydroxybutan-2-yl]-7-[(1R)-1-hydroxyethyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide
  • AB01275486-01
  • D-Phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L- threonyl-N-((1R,2R)-2-hydroxy-1-(hydroxymethyl)propyl)-L- cysteinamide cyclic (2->7)-disulfide
  • L-Cysteinamide, D-phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L-threonyl-N-(2-hydroxy-1-(hydroxymethyl)propyl)-, cyclic (2->7)-disulfide, (R-(R*,R*))-
  • D-Phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L-threonyl-L-cysteinyl-L-threoninol cyclic (2->7)-disulfide
  • OCTREOTIDE [MI]
  • Octreotide [USAN:INN:BAN]
  • Octreotidum
  • SMS-201-995
  • DTXSID0048682
  • OCTREOTIDE (EP MONOGRAPH)
  • HS-2020
  • EX-A4865
  • SMS-995
  • RWM8CCW8GP
  • Octreotidum (Latin)
  • SCHEMBL10044649
  • DRG-0115
  • L-Cysteinamide, D-phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L-threonyl-N-(2-hydroxy-1-(hydroxymethyl)propyl)-, cyclic (2-7)-disulfide, (R-(R*,R*))-
  • 79517-01-4
  • OCTREOTIDE [INN]
  • Octrotide
  • SMS 201,995
  • H01CB02
  • 10-(4-Amino-butyl)-19-(2-amino-3-phenyl-propionylamino)-16-benzyl-7-(1-hydroxy-ethyl)-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaaza-cycloicosane-4-carboxylic acid (2-hydroxy-1-hydroxymethyl-propyl)-amide
  • AKOS015994656
  • D-Phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L-threonyl-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)propyl]-L-cysteinamide Cyclic (2-7)-Disulfide Acetate
  • D-Phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L-threonyl-N-((1R,2R)-2-hydroxy-1-(hyroxymethyl)propyl)-L-cysteinamide, Cyclic (2->7)-disulfide
  • D-Phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L-threonyl-N-((1R,2R)-2-hydroxy-1-(hydroxymethyl)propyl)-L-cysteinamide cyclic (2->7)-disulfide
  • D-PHENYLALANYL-L-HEMICYSTYL-L-PHENYLALANYL-D-TRYPTOPHYL-L-LYSYL-L-THREONYL-L-HEMICYSTYL-L-THREONINOL CYCLIC (2->7)-DISULFIDE
  • 10-(4-Amino-butyl)-19-(2-amino-3-phenyl-propionylamino)-16-benzyl-7-(1-hydroxy-ethyl)-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaaza-cycloicosane-4-carboxylic acid (2-hydroxy-1-
  • [R-(R*,R*)]-D-Phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L-threonyl-N-[2-hydroxy-1-(hydroxy-methyl)propyl]-cysteinamide cyclic(2-->7)-disulfide
  • DEQANNDTNATYII-OULOTJBUSA-N
  • Q-201501
  • (4R,7S,10S,13R,16S,19R)-10-(4-aminobutyl)-19-[[(2R)-2-amino-3-phenyl-propanoyl]amino]-16-benzyl-7-[(1R)-1-hydroxyethyl]-N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)propyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide
  • Octreotide CRS
  • CHEBI:7726
  • OCTREOTIDE [VANDF]
  • DB00104
  • 2-{[(13R,16S,19R)-10-(4-Amino-butyl)-19-((S)-2-amino-3-phenyl-propionylamino)-16-benzyl-7-(1-hydroxy-ethyl)-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaaza-cycloicosane-4-carbonyl]-amino}-3-hydroxy-butyric acid
  • HMS2090C09
  • OCTREOTIDE [WHO-DD]
  • Octreotidum [Latin]
  • OCTREOTIDE [USAN]
  • 10-(4-Aminobutyl)-19-((2-amino-3-phenylpropanoyl)amino)-16-benzyl-7-(1-hydroxyethyl)-N-(2-hydroxy-1-(hydroxymethyl)propyl)-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carboxamide acetate
  • Octreotida
  • D-Phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L-threonyl-N-((1R,2R)-2-hydroxy-1-(hydroxymethyl)propyl)-L-cysteinamide cyclic (2-7)-disulfide
  • Octreotida [Spanish]
  • (4R,7S,10S,13R,16S,19R)-13-((1H-indol-3-yl)methyl)-19-((R)-2-amino-3-phenylpropanamido)-10-(4-aminobutyl)-16-benzyl-N-((2R,3R)-1,3-dihydroxybutan-2-yl)-7-((R)-1-hydroxyethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carboxamide
  • H-D-Phe-Cys-Phe-D-Trp-Lys-Thr-Cys-L-threoninol disulfide bond acetate salt
  • Octreotide-LAR
  • L-Cysteinamide, D-phenylalanyl-L-cysteinyl-L-phenylalanyl-D-tryptophyl-L-lysyl-L- threonyl-N-(2-hydroxy-1-(hydroxymethyl)propyl)-, cyclic (2->7)-disulfide, (R-(R*,R*))-
  • SMS995
  • CHEMBL1680
物化性质
实验特性
LogP 3.02100
PSA 382.82000
折射率 1.673
沸点 1447.228°C at 760 mmHg
闪点 829.053°C
溶解度 H2O: soluble
颜色与性状 不可用
溶解性 不可用
密度 1.395
计算特性
精确分子量 1018.44000
氢键供体数量 13
氢键受体数量 20
可旋转化学键数量 19
同位素质量 1018.44
重原子数量 71
复杂度 1740
同位素原子数量 0
确定原子立构中心数量 0
不确定原子立构中心数量 10
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 1
疏水参数计算参考值(XlogP) 1
拓扑分子极性表面积 383A^2
海关数据
海关编码 3004909090
海关数据

中国海关编码:

3004909090
专业数据库参考
PubChemId 165412376
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