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Substance Name: Albumin herborn
RN: 149786-91-4
InChIKey: SUAWHJYITAWCJF-DAKDHRHFSA-N

Note

  • Lys replaced by Glu at position 240; a new genetic variant of human serum albumin found in Germany.

Molecular Formula

  • C143-H231-N41-O53-S3

Molecular Weight

  • 3468.8299
 
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Names and Synonyms

Name of Substance

  • Albumin herborn

Systematic Name

  • L-Arginine, L-valyl-L-seryl-L-lysyl-L-leucyl-L-valyl-L-threonyl-L-alpha-aspartyl-L-leucyl-L-threonyl-L-alpha-glutamyl-L-valyl-L-histidyl-L-threonyl-L-alpha-glutamyl-L-valyl-L-histidyl-L-threnoyl-L-alpha-glutamyl-L-cysteinyl-L-cysteinyl-L-histidylglycyl-L-alpha-aspartyl-L-leucyl-L-leucyl-L-alpha-glutamyl-L-cysteinyl-L-alanyl-L-alpha-aspartyl-L-alpha-aspartyl-

Registry Numbers

CAS Registry Number

  • 149786-91-4

System Generated Number

  • 0149786914

Structure Descriptors

InChI

1S/C143H231N41O53S3/c1-59(2)37-81(120(214)159-76(27-31-97(191)192)116(210)175-93(53-238)131(225)156-67(17)113(207)164-89(45-102(201)202)124(218)170-90(46-103(203)204)123(217)163-80(142(236)237)26-24-36-151-143(146)147)166-121(215)82(38-60(3)4)167-122(216)88(44-101(199)200)157-96(190)51-152-114(208)85(41-72-48-148-56-153-72)169-132(226)94(54-239)177-133(227)95(55-240)176-117(211)77(28-32-98(193)194)160-138(232)110(69(19)187)182-128(222)86(42-73-49-149-57-154-73)171-135(229)107(65(13)14)179-119(213)79(30-34-100(197)198)162-140(234)111(70(20)188)183-129(223)87(43-74-50-150-58-155-74)172-136(230)106(64(11)12)178-118(212)78(29-33-99(195)196)161-139(233)109(68(18)186)181-127(221)84(40-62(7)8)168-125(219)91(47-104(205)206)173-141(235)112(71(21)189)184-137(231)108(66(15)16)180-126(220)83(39-61(5)6)165-115(209)75(25-22-23-35-144)158-130(224)92(52-185)174-134(228)105(145)63(9)10/h48-50,56-71,75-95,105-112,185-189,238-240H,22-47,51-55,144-145H2,1-21H3,(H,148,153)(H,149,154)(H,150,155)(H,152,208)(H,156,225)(H,157,190)(H,158,224)(H,159,214)(H,160,232)(H,161,233)(H,162,234)(H,163,217)(H,164,207)(H,165,209)(H,166,215)(H,167,216)(H,168,219)(H,169,226)(H,170,218)(H,171,229)(H,172,230)(H,173,235)(H,174,228)(H,175,210)(H,176,211)(H,177,227)(H,178,212)(H,179,213)(H,180,220)(H,181,221)(H,182,222)(H,183,223)(H,184,231)(H,191,192)(H,193,194)(H,195,196)(H,197,198)(H,199,200)(H,201,202)(H,203,204)(H,205,206)(H,236,237)(H4,146,147,151)/t67-,68+,69+,70+,71+,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,105-,106-,107-,108-,109-,110-,111-,112-/m0/s1

InChIKey

SUAWHJYITAWCJF-DAKDHRHFSA-N

Smiles

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc3cnc[nH]3)NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)C(C)C)[C@@H](C)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O