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Chemistry, part 1

Content language

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Concept information

... > organooxygen compound > carbonyl compound > carboxylic acid > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > fendlerinine b
... > organooxygen compound > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > fendlerinine b
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > fendlerinine b
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > fendlerinine b
organic aromatic compound > aromatic carboxylic acid > benzoic acids > methoxybenzoic acid > fendlerinine b

Preferred term

fendlerinine b  

Type

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

Broader concept

charge

  • 0

formula

  • C28H39NO8

inchi

  • InChI=1S/C28H39NO8/c1-15-22(36-6)21(25(33)34)16-12-29(13-19(30)31)24(32)20(16)23(15)37-14-18-27(4)10-7-9-26(2,3)17(27)8-11-28(18,5)35/h17-18,35H,7-14H2,1-6H3,(H,30,31)(H,33,34)/t17-,18+,27-,28+/m0/s1

inchikey

  • PXDWLLNSVIWIRA-UZLXAVLXSA-N

mass

  • 517.619

monoisotopicmass

  • 517.26757

smiles

  • O=C1N(CC=2C1=C(OC[C@H]3[C@](O)(CC[C@@H]4[C@@]3(CCCC4(C)C)C)C)C(=C(OC)C2C(=O)O)C)CC(=O)O

subset

  • 2_STAR

synonym EXACT

  • 7-[[(1S,2R,4aS,8aS)-2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methoxy]-2-(carboxymethyl)-5-methoxy-6-methyl-1-oxo-3H-isoindole-4-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214805

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