(Q105125814)

English

H-DL-Pyr-DL-Ala-DL-Asp-DL-Pro-DL-Lys-DL-xiThr-DL-Phe-DL-Tyr-Gly-DL-Leu-DL-Met-NH2

group of stereoisomers with the chemical formula C₅₈H₈₅N₁₃O₁₆S

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Statements

group of stereoisomers

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chemical compound

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1,251.5957946399994 dalton

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based on heuristic

inferred from InChI

chemical formula

C₅₈H₈₅N₁₃O₁₆S

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canonical SMILES

CSCCC(NC(=O)C(CC(C)C)NC(=O)CNC(=O)C(Cc1ccc(O)cc1)NC(=O)C(Cc1ccccc1)NC(=O)C(NC(=O)C(CCCCN)NC(=O)C1CCCN1C(=O)C(CC(=O)O)NC(=O)C(C)NC(=O)C1CCC(=O)N1)C(C)O)C(N)=O

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Identifiers

InChI=1S/C58H85N13O16S/c1-31(2)26-40(54(83)65-37(49(60)78)22-25-88-5)64-46(75)30-61-51(80)41(28-35-16-18-36(73)19-17-35)67-55(84)42(27-34-12-7-6-8-13-34)68-57(86)48(33(4)72)70-53(82)38(14-9-10-23-59)66-56(85)44-15-11-24-71(44)58(87)43(29-47(76)77)69-50(79)32(3)62-52(81)39-20-21-45(74)63-39/h6-8,12-13,16-19,31-33,37-44,48,72-73H,9-11,14-15,20-30,59H2,1-5H3,(H2,60,78)(H,61,80)(H,62,81)(H,63,74)(H,64,75)(H,65,83)(H,66,85)(H,67,84)(H,68,86)(H,69,79)(H,70,82)(H,76,77)

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JDWGXVXQFARQIG-UHFFFAOYSA-N

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1 reference

15 September 2022

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