CAS 861136-76-7 | L-Asparagine, L-alanyl-L-arginyl-L-seryl-L-threonyl-L-arginyl-L-threonyl- | CAS Number 861136-76-7

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861136-76-7 | L-Asparagine, L-alanyl-L-arginyl-L-seryl-L-threonyl-L-arginyl-L-threonyl-

CAS No: 861136-76-7 Catalog No: AG004TXC MDL No:

Product Description

Catalog Number:

AG004TXC

Chemical Name:

L-Asparagine, L-alanyl-L-arginyl-L-seryl-L-threonyl-L-arginyl-L-threonyl-

CAS Number:

861136-76-7

Molecular Formula:

C30H56N14O12

Molecular Weight:

804.8522

IUPAC Name:

(2S)-4-amino-2-[[(2S,3R)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-hydroxypropanoyl]amino]-3-hydroxybutanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoic acid

InChI:

InChI=1S/C30H56N14O12/c1-12(31)22(49)39-15(6-4-8-37-29(33)34)23(50)42-18(11-45)25(52)44-20(13(2)46)26(53)40-16(7-5-9-38-30(35)36)24(51)43-21(14(3)47)27(54)41-17(28(55)56)10-19(32)48/h12-18,20-21,45-47H,4-11,31H2,1-3H3,(H2,32,48)(H,39,49)(H,40,53)(H,41,54)(H,42,50)(H,43,51)(H,44,52)(H,55,56)(H4,33,34,37)(H4,35,36,38)/t12-,13+,14+,15-,16-,17-,18-,20-,21-/m0/s1

InChI Key:

IBRXIZGGSVTFHT-JIBOYFAPSA-N

SMILES:

OC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)N)[C@H](O)C)CCCNC(=N)N)[C@H](O)C)NC(=O)[C@@H](NC(=O)[C@@H](N)C)CCCNC(=N)N