skip to main content

Chemistry, part 2

Content language

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

Concept information

organooxygen compound > oxacycle > branimycin b
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > branimycin b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > branimycin b
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > branimycin b

Preferred term

branimycin b  

Type

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

Broader concept

charge

  • 0

formula

  • C23H34O8

inchi

  • InChI=1S/C23H34O8/c1-10-7-11(2)23-15(14(9-29-4)22(28)30-20(10)16(25)8-24)6-5-13-17(23)18(26)12(3)19(27)21(13)31-23/h5-7,10,12-21,24-27H,8-9H2,1-4H3/b11-7+/t10-,12-,13-,14-,15-,16-,17+,18-,19-,20+,21-,23+/m1/s1

inchikey

  • VQHBSPRDIQVOOD-MGBSWPCYSA-N

mass

  • 438.517

monoisotopicmass

  • 438.22537

smiles

  • O=C1O[C@@H]([C@@H](C=C([C@]23[C@@H]([C@H]1COC)C=C[C@@H]4[C@H]2[C@H](O)[C@@H](C)[C@H]([C@@H]4O3)O)C)C)[C@H](O)CO

subset

  • 2_STAR

synonym EXACT

  • (1S,3R,4R,5R,6R,7S,8R,11R,12S,15S,16R,17E)-15-[(1R)-1,2-dihydroxyethyl]-4,6-dihydroxy-12-(methoxymethyl)-5,16,18-trimethyl-2,14-dioxatetracyclo[9.7.0.01,7.03,8]octadeca-9,17-dien-13-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:206800

Download this concept:

RDF/XML TURTLE JSON-LD