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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > peptide > mc-hila
organooxygen compound > carboxamide > peptide > mc-hila
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > mc-hila
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > mc-hila
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > mc-hila

Preferred term

mc-hila  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C47H69N7O12

inchi

  • InChI=1S/C47H69N7O12/c1-12-25(2)23-36-45(61)53-39(47(64)65)29(6)41(57)48-30(7)42(58)50-34(19-18-26(3)22-27(4)37(66-11)24-33-16-14-13-15-17-33)28(5)40(56)51-35(46(62)63)20-21-38(55)54(10)32(9)44(60)49-31(8)43(59)52-36/h13-19,22,25,27-31,34-37,39H,9,12,20-21,23-24H2,1-8,10-11H3,(H,48,57)(H,49,60)(H,50,58)(H,51,56)(H,52,59)(H,53,61)(H,62,63)(H,64,65)/b19-18+,26-22+/t25-,27-,28-,29-,30-,31+,34-,35+,36-,37-,39+/m0/s1

inchikey

  • WWIGXTSAJMYWND-JSIJJRETSA-N

mass

  • 924.106

monoisotopicmass

  • 923.50042

smiles

  • O=C1N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)O)[C@@H](C(=O)N[C@@H](C)C(N[C@H]([C@@H](C(N[C@H](CCC(N(C1=C)C)=O)C(=O)O)=O)C)/C=C/C(=C/[C@@H]([C@@H](OC)CC2=CC=CC=C2)C)/C)=O)C)C[C@H](CC)C)C

subset

  • 2_STAR

synonym EXACT

  • (5R,8S,11R,12S,15S,18S,19S,22R)-18-[(1E,3E,5S,6S)-6-methoxy-3,5-dimethyl-7-phenylhepta-1,3-dienyl]-1,5,12,15,19-pentamethyl-8-[(2S)-2-methylbutyl]-2-methylidene-3,6,9,13,16,20,25-heptaoxo-1,4,7,10,14,17,21-heptazacyclopentacosane-11,22-dicarboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:222424

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