CAS 742068-40-2 | L-Valine, L-glutaminyl-L-prolyl-L-seryl-L-glutaminyl-L-prolylglycylglycyl- | CAS Number 742068-40-2

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742068-40-2 | L-Valine, L-glutaminyl-L-prolyl-L-seryl-L-glutaminyl-L-prolylglycylglycyl-

CAS No: 742068-40-2 Catalog No: AG005DDI MDL No:

Product Description

Catalog Number:

AG005DDI

Chemical Name:

L-Valine, L-glutaminyl-L-prolyl-L-seryl-L-glutaminyl-L-prolylglycylglycyl-

CAS Number:

742068-40-2

Molecular Formula:

C32H52N10O12

Molecular Weight:

768.8151

IUPAC Name:

(2S)-2-[[2-[[2-[[(2S)-1-[(2S)-5-amino-2-[[(2S)-2-[[(2S)-1-[(2S)-2,5-diamino-5-oxopentanoyl]pyrrolidine-2-carbonyl]amino]-3-hydroxypropanoyl]amino]-5-oxopentanoyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]acetyl]amino]-3-methylbutanoic acid

InChI:

InChI=1S/C32H52N10O12/c1-16(2)26(32(53)54)40-25(47)14-36-24(46)13-37-28(49)20-5-3-12-42(20)31(52)18(8-10-23(35)45)38-27(48)19(15-43)39-29(50)21-6-4-11-41(21)30(51)17(33)7-9-22(34)44/h16-21,26,43H,3-15,33H2,1-2H3,(H2,34,44)(H2,35,45)(H,36,46)(H,37,49)(H,38,48)(H,39,50)(H,40,47)(H,53,54)/t17-,18-,19-,20-,21-,26-/m0/s1

InChI Key:

HXPJQGJHIRAFSS-PFZXUFBWSA-N

SMILES:

OC[C@@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)NCC(=O)N[C@H](C(=O)O)C(C)C)CCC(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)N)N