skip to main content

Chemistry, part 2

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 > isoprenoid > terpenoid > monoterpenoid > benwamycin d
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > monoterpenoid > benwamycin d

Preferred term

benwamycin d  

Type

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

Broader concept

charge

  • 0

formula

  • C20H28O5

inchi

  • InChI=1S/C20H28O5/c1-5-19(24)25-20(13(2)15(4)23)14(3)18-9-8-16(12-22)11-17(18)7-6-10-21/h6-9,11,13-14,20-22H,5,10,12H2,1-4H3/b7-6+/t13-,14+,20+/m1/s1

inchikey

  • KXWCDNGXRAPJLE-XSMXVWRTSA-N

mass

  • 348.439

monoisotopicmass

  • 348.19367

smiles

  • O=C(O[C@H]([C@H](C1=C(C=C(CO)C=C1)/C=C/CO)C)[C@@H](C(=O)C)C)CC

subset

  • 2_STAR

synonym EXACT

  • [(2S,3R,4S)-2-[4-(hydroxymethyl)-2-[(E)-3-hydroxyprop-1-enyl]phenyl]-4-methyl-5-oxohexan-3-yl] propanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:225652

Download this concept:

RDF/XML TURTLE JSON-LD