Concept information
Preferred term
میکروژینین KR787
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C40H58ClN5O9
inchi
- InChI=1S/C40H58ClN5O9/c1-25(2)22-34(39(53)46-21-9-11-33(46)36(50)44-32(40(54)55)24-27-14-18-29(48)19-15-27)45(3)38(52)31(23-26-12-16-28(47)17-13-26)43-37(51)35(49)30(42)10-7-5-4-6-8-20-41/h12-19,25,30-35,47-49H,4-11,20-24,42H2,1-3H3,(H,43,51)(H,44,50)(H,54,55)/t30-,31+,32+,33-,34-,35-/m0/s1
inchikey
- LDCCHPQMLCMPIZ-RDWYLJQVSA-N
mass
- 788.380
monoisotopicmass
- 787.39231
smiles
- ClCCCCCCC[C@H](N)[C@H](O)C(=O)N[C@@H](C(=O)N([C@H](C(=O)N1[C@H](C(=O)N[C@@H](C(=O)O)CC2=CC=C(O)C=C2)CCC1)CC(C)C)C)CC3=CC=C(O)C=C3
subset
- 2_STAR
synonym EXACT
- (2R)-2-[[(2S)-1-[(2S)-2-[[(2R)-2-[[(2S,3S)-3-amino-10-chloro-2-hydroxydecanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]-methylamino]-4-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-3-(4-hydroxyphenyl)propanoic acid
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:213834
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