skip to main content

Chemistry, part 1

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > phenols > hydroxybenzoic acid > roseopurpurin a
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > hydroxybenzoic acid > roseopurpurin a
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > organic hydroxy compound > phenols > hydroxybenzoic acid > roseopurpurin a
organic aromatic compound > phenols > hydroxybenzoic acid > roseopurpurin a
... > organooxygen compound > carbonyl compound > carboxylic acid > aromatic carboxylic acid > benzoic acids > hydroxybenzoic acid > roseopurpurin a
... > organooxygen compound > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > hydroxybenzoic acid > roseopurpurin a
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > aromatic carboxylic acid > benzoic acids > hydroxybenzoic acid > roseopurpurin a
... > 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 > hydroxybenzoic acid > roseopurpurin a
organic aromatic compound > aromatic carboxylic acid > benzoic acids > hydroxybenzoic acid > roseopurpurin a

Preferred term

roseopurpurin a  

Type

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

Broader concept

charge

  • 0

formula

  • C18H22O8

inchi

  • InChI=1S/C18H22O8/c1-7-6-10(19)8(2)14(11(7)17(23)24)26-16-13(21)9(3)12(20)15(22)18(16,4)25-5/h6,15-16,19-20,22H,1-5H3,(H,23,24)/t15-,16+,18+/m1/s1

inchikey

  • OFAIPEZAGBTTCZ-RYRKJORJSA-N

mass

  • 366.366

monoisotopicmass

  • 366.13147

smiles

  • O=C1C(=C(O)[C@@H](O)[C@@]([C@H]1OC2=C(C(=CC(=C2C)O)C)C(=O)O)(OC)C)C

subset

  • 2_STAR

synonym EXACT

  • 2-[(1R,5R,6S)-4,5-dihydroxy-6-methoxy-3,6-dimethyl-2-oxocyclohex-3-en-1-yl]oxy-4-hydroxy-3,6-dimethylbenzoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201237

Download this concept:

RDF/XML TURTLE JSON-LD