CAS 821800-90-2 | L-Tryptophan, L-seryl-L-prolyl-L-leucyl-L-phenylalanyl-L-lysyl-L-prolyl- | CAS Number 821800-90-2

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821800-90-2 | L-Tryptophan, L-seryl-L-prolyl-L-leucyl-L-phenylalanyl-L-lysyl-L-prolyl-

CAS No: 821800-90-2 Catalog No: AG0050JT MDL No:

Product Description

Catalog Number:

AG0050JT

Chemical Name:

L-Tryptophan, L-seryl-L-prolyl-L-leucyl-L-phenylalanyl-L-lysyl-L-prolyl-

CAS Number:

821800-90-2

Molecular Formula:

C45H63N9O9

Molecular Weight:

874.0366

IUPAC Name:

(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-amino-3-hydroxypropanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-3-(1H-indol-3-yl)propanoic acid

InChI:

InChI=1S/C45H63N9O9/c1-27(2)22-34(51-41(58)37-17-10-20-53(37)43(60)31(47)26-55)39(56)50-35(23-28-12-4-3-5-13-28)40(57)49-33(16-8-9-19-46)44(61)54-21-11-18-38(54)42(59)52-36(45(62)63)24-29-25-48-32-15-7-6-14-30(29)32/h3-7,12-15,25,27,31,33-38,48,55H,8-11,16-24,26,46-47H2,1-2H3,(H,49,57)(H,50,56)(H,51,58)(H,52,59)(H,62,63)/t31-,33-,34-,35-,36-,37-,38-/m0/s1

InChI Key:

GEBSSMZSAJSJJJ-FCNDXCBGSA-N

SMILES:

NCCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)Cc1c[nH]c2c1cccc2)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)N)CC(C)C