Chem
J-GLOBAL ID：200907002743356023
Nikkaji number：J1.199.710D
LFcinB
ウシラクトフェリシン
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C144H229N47O30S3
Molecular formula furigana： C144-H229-N47-O30-S3
Molecular weight： 3194.900
InChI：
InChI=1S/C144H229N47O30S3/c1-12-78(6)113-136(217)190-114(82(10)193)137(218)187-108(133(214)188-112(77(4)5)135(216)180-99(50-33-62-164-144(158)159)122(203)174-95(46-29-58-160-140(150)151)118(199)169-79(7)115(196)181-103(67-84-37-17-14-18-38-84)128(209)170-81(9)139(220)221)75-224-223-74-107(186-125(206)92(43-23-26-55-145)171-116(197)89(148)66-83-35-15-13-16-36-83)132(213)177-97(48-31-60-162-142(154)155)120(201)175-98(49-32-61-163-143(156)157)124(205)183-105(69-86-71-166-91-42-22-20-40-88(86)91)130(211)178-100(52-53-110(149)194)126(207)184-104(68-85-70-165-90-41-21-19-39-87(85)90)129(210)176-96(47-30-59-161-141(152)153)121(202)179-101(54-64-222-11)127(208)173-93(44-24-27-56-146)119(200)172-94(45-25-28-57-147)123(204)182-102(65-76(2)3)117(198)167-72-111(195)168-80(8)138(219)191-63-34-51-109(191)134(215)185-106(73-192)131(212)189-113/h13-22,35-42,70-71,76-82,89,92-109,112-114,165-166,192-193H,12,23-34,43-69,72-75,145-148H2,1-11H3,(H2,149,194)(H,167,198)(H,168,195)(H,169,199)(H,170,209)(H,171,197)(H,172,200)(H,173,208)(H,174,203)(H,175,201)(H,176,210)(H,177,213)(H,178,211)(H,179,202)(H,180,216)(H,181,196)(H,182,204)(H,183,205)(H,184,207)(H,185,215)(H,186,206)(H,187,218)(H,188,214)(H,189,212)(H,190,217)(H,220,221)(H4,150,151,160)(H4,152,153,161)(H4,154,155,162)(H4,156,157,163)(H4,158,159,164)
InChI key：
WNFFJPOBYBQDOX-UHFFFAOYSA-N
SMILES：
CCC(C)C1NC(=O)C(CO)NC(=O)C2CCCN2C(=O)C(C)NC(=O)CNC(=O)C(CC(C)C)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(CCSC)NC(=O)C(CCCNC(=N)N)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(CCC(=O)N)NC(=O)C(Cc2c[nH]c3ccccc23)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CSSCC(NC(=O)C(NC1=O)C(C)O)C(=O)NC(C(C)C)C(=O)NC(CCCNC(=N)N)C(=O)NC(CCCNC(=N)N)C(=O)NC(C)C(=O)NC(Cc1ccccc1)C(=O)NC(C)C(=O)O)NC(=O)C(CCCCN)NC(=O)C(N)Cc1ccccc1
Systematic name (3)：
- L-Phe-L-Lys-L-Cys(1)-L-Arg-L-Arg-L-Trp-L-Gln-L-Trp-L-Arg-L-Met-L-Lys-L-Lys-L-Leu-Gly-L-Ala-L-Pro-L-Ser-L-Ile-L-Thr-L-Cys(1)-L-Val-L-Arg-L-Arg-L-Ala-L-Phe-L-Ala-OH
- 2-{2-[2-(2-{2-[2-({17-[6-アミノ-2-(2-アミノ-3-フェニルプロパンアミド)ヘキサンアミド]-41,44-ビス(4-アミノブチル)-6-(ブタン-2-イル)-20,23,35-トリス(3-カルバムイミドアミドプロピル)-29-(2-カルバモイルエチル)-9-(1-ヒドロキシエチル)-3-(ヒドロキシメチル)-26,32-ビス[(1H-インドール-3-イル)メチル]-53-メチル-47-(2-メチルプロピル)-38-[2-(メチルスルファニル)エチル]-1,4,7,10,18,21,24,27,30,33,36,39,42,45,48,51,54-ヘプタデカオキソ-ヘキサペンタコンタヒドロピロロ[2,1-p]1,2-ジチア-5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50,53-ヘプタデカアザシクロヘキサペンタコンタン-12-イル}ホルムアミド)-3-メチルブタンアミド]-5-カルバムイミドアミドペンタンアミド}-5-カルバムイミドアミドペンタンアミド)プロパンアミド]-3-フェニルプロパンアミド}プロパン酸
- 2-{2-[2-(2-{2-[2-({17-[6-amino-2-(2-amino-3-phenylpropanamido)hexanamido]-41,44-bis(4-aminobutyl)-6-(butan-2-yl)-20,23,35-tris(3-carbamimidamidopropyl)-29-(2-carbamoylethyl)-9-(1-hydroxyethyl)-3-(hydroxymethyl)-26,32-bis[(1H-indol-3-yl)methyl]-53-methyl-47-(2-methylpropyl)-38-[2-(methylsulfanyl)ethyl]-1,4,7,10,18,21,24,27,30,33,36,39,42,45,48,51,54-heptadecaoxo-hexapentacontahydropyrrolo[2,1-p]1,2-dithia-5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50,53-heptadecaazacyclohexapentacontan-12-yl}formamido)-3-methylbutanamido]-5-carbamimidamidopentanamido}-5-carbamimidamidopentanamido)propanamido]-3-phenylpropanamido}propanoic acid
- LFcinB
- LFcin B
- ウシラクトフェリシン
- Bovine lactoferricin
- ラクトフェリシン【ウシ】
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