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 > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > organosulfur heterocyclic compound > weishanmycin a1
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organosulfur heterocyclic compound > weishanmycin a1
... > 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 > organosulfur heterocyclic compound > weishanmycin a1
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organosulfur heterocyclic compound > weishanmycin a1

Preferred term

weishanmycin a1  

Type

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

Broader concept

charge

  • 0

formula

  • C25H34N2O4S2

inchi

  • InChI=1S/C25H34N2O4S2/c1-5-6-18-8-7-16(2)11-20-24(4,31)9-10-25(33-20,14-22(29)30)13-21(28)26-17(3)23-27-19(12-18)15-32-23/h7-8,12,15,17,20,31H,2,5-6,9-11,13-14H2,1,3-4H3,(H,26,28)(H,29,30)/b8-7+,18-12?/t17-,20-,24+,25+/m1/s1

inchikey

  • AJDKITCLGCYCKZ-FLBOQRJTSA-N

mass

  • 490.680

monoisotopicmass

  • 490.19600

smiles

  • S1[C@@]2(CC(=O)N[C@@H](C=3SC=C(N3)C=C(C=CC(C[C@@H]1[C@](O)(C)CC2)=C)CCC)C)CC(=O)O

subset

  • 2_STAR

synonym EXACT

  • 2-[(1S,5R,12E,16R,17S)-17-hydroxy-5,17-dimethyl-14-methylidene-3-oxo-11-propyl-7,20-dithia-4,21-diazatricyclo[14.3.1.16,9]henicosa-6(21),8,10,12-tetraen-1-yl]acetic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:219552

Download this concept:

RDF/XML TURTLE JSON-LD