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Neuromedin N

Properties

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Occurences in reactions

MNX_ID

MNXM1103729

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	3

formula

C₃₂H₅₁N₅O₇

charge

mass

617.37885

reference

biggM:CE5797

InChIKey

NSLIVCMCAULZET-WFJLUAAKSA-N

InChI

InChI=1S/C32H51N5O7/c1-7-19(5)26(33)31(42)37-15-9-10-25(37)29(40)34-23(17-21-11-13-22(38)14-12-21)28(39)36-27(20(6)8-2)30(41)35-24(32(43)44)16-18(3)4/h11-14,18-20,23-27,38H,7-10,15-17,33H2,1-6H3,(H,34,40)(H,35,41)(H,36,39)(H,43,44)/t19-,20-,23+,24+,25+,26-,27-/m1/s1

SMILES

CC[C@@H](C)[C@@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)[O-])[C@H](C)CC

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
bigg.metabolite:CE5797 biggM:CE5797	Neuromedin N
hmdb:HMDB0013022	Neuromedin N (2S)-2-[(2R,3R)-2-[(2S)-2-{[(2S)-1-[(2R,3R)-2-amino-3-methylpentanoyl]pyrrolidin-2-yl]formamido}-3-(4-hydroxyphenyl)propanamido]-3-methylpentanamido]-4-methylpentanoic acid (2S)-2-{[(2R,3R)-2-{[(2S)-2-({[(2S)-1-[(2R,3R)-2-amino-3-methylpentanoyl]pyrrolidin-2-yl](hydroxy)methylidene}amino)-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino}-1-hydroxy-3-methylpentylidene]amino}-4-methylpentanoate NN
hmdb:HMDB13022 biggM:M_CE5797	secondary/obsolete/fantasy identifier