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Substance Name: N(epsilon)-Acetimidoglucagon
RN: 74619-75-3
InChIKey: VYBYTAXIGUPQBB-JPFJGECISA-N

Molecular Formula

  • C155-H228-N44-O49-S

Molecular Weight

  • 3523.8312
 
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Names and Synonyms

Name of Substance

  • N(epsilon)-Acetimidoglucagon

Synonyms

  • N(epsilon)-Acetamidoglucagon
  • N(epsilon)-Lysine acetimidoglucagon
  • N-epsilon-Acetimidoglucagon

Systematic Name

  • Glucagon (pig), 12-(N6-(1-iminoethyl)-L-lysine)-

Registry Numbers

CAS Registry Number

  • 74619-75-3

System Generated Number

  • 0074619753

Structure Descriptors

InChI

1S/C155H228N44O49S/c1-73(2)53-99(135(229)179-98(48-52-249-12)134(228)187-106(61-117(161)212)145(239)199-125(79(10)206)153(247)248)182-139(233)105(59-85-65-170-91-30-20-19-29-89(85)91)186-133(227)97(44-47-116(160)211)180-150(244)122(75(5)6)197-143(237)103(55-81-25-15-13-16-26-81)185-140(234)107(62-119(214)215)188-132(226)96(43-46-115(159)210)174-126(220)76(7)173-129(223)93(32-23-50-168-154(162)163)175-130(224)94(33-24-51-169-155(164)165)177-148(242)112(70-202)194-142(236)109(64-121(218)219)189-136(230)100(54-74(3)4)181-137(231)101(57-83-34-38-87(207)39-35-83)183-131(225)92(31-21-22-49-167-80(11)156)176-147(241)111(69-201)193-138(232)102(58-84-36-40-88(208)41-37-84)184-141(235)108(63-120(216)217)190-149(243)113(71-203)195-152(246)124(78(9)205)198-144(238)104(56-82-27-17-14-18-28-82)191-151(245)123(77(8)204)196-118(213)67-171-128(222)95(42-45-114(158)209)178-146(240)110(68-200)192-127(221)90(157)60-86-66-166-72-172-86/h13-20,25-30,34-41,65-66,72-79,90,92-113,122-125,170,200-208H,21-24,31-33,42-64,67-71,157H2,1-12H3,(H2,156,167)(H2,158,209)(H2,159,210)(H2,160,211)(H2,161,212)(H,166,172)(H,171,222)(H,173,223)(H,174,220)(H,175,224)(H,176,241)(H,177,242)(H,178,240)(H,179,229)(H,180,244)(H,181,231)(H,182,233)(H,183,225)(H,184,235)(H,185,234)(H,186,227)(H,187,228)(H,188,226)(H,189,230)(H,190,243)(H,191,245)(H,192,221)(H,193,232)(H,194,236)(H,195,246)(H,196,213)(H,197,237)(H,198,238)(H,199,239)(H,214,215)(H,216,217)(H,218,219)(H,247,248)(H4,162,163,168)(H4,164,165,169)/t76-,77+,78+,79+,90-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,109-,110-,111-,112-,113-,122-,123-,124-,125-/m0/s1

InChIKey

VYBYTAXIGUPQBB-JPFJGECISA-N

Smiles

CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H](NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc4ccc(O)cc4)NC(=O)[C@H](CCCCNC(=N)C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc5ccc(O)cc5)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc6ccccc6)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc7cnc[nH]7)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)O