skip to main content

Chemistry, part 1

Content language

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

Concept information

... > organooxygen compound > ester > carboxylic ester > lactone > cyclodepsipeptide > 27-deoxylyngbyabellin a
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > cyclodepsipeptide > 27-deoxylyngbyabellin a
organooxygen compound > ester > lactone > cyclodepsipeptide > 27-deoxylyngbyabellin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > peptide > depsipeptide > cyclodepsipeptide > 27-deoxylyngbyabellin a
... > organooxygen compound > carboxamide > peptide > depsipeptide > cyclodepsipeptide > 27-deoxylyngbyabellin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > depsipeptide > cyclodepsipeptide > 27-deoxylyngbyabellin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > depsipeptide > cyclodepsipeptide > 27-deoxylyngbyabellin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > depsipeptide > cyclodepsipeptide > 27-deoxylyngbyabellin a

Preferred term

27-deoxylyngbyabellin a  

Type

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

Broader concept

charge

  • 0

formula

  • C29H40Cl2N4O6S2

inchi

  • InChI=1S/C29H40Cl2N4O6S2/c1-8-16(4)21-24-34-18(14-42-24)26(38)40-19(10-9-11-29(7,30)31)28(5,6)27(39)41-22(15(2)3)25-33-17(13-43-25)23(37)32-12-20(36)35-21/h13-16,19,21-22H,8-12H2,1-7H3,(H,32,37)(H,35,36)/t16-,19-,21-,22-/m0/s1

inchikey

  • MXKVWNSSDRMDBC-PWZKMPOXSA-N

mass

  • 675.680

monoisotopicmass

  • 674.17663

smiles

  • ClC(Cl)(CCC[C@@H]1OC(=O)C=2N=C([C@@H](NC(=O)CNC(C=3N=C([C@@H](OC(C1(C)C)=O)C(C)C)SC3)=O)[C@H](CC)C)SC2)C

subset

  • 2_STAR

synonym EXACT

  • (7S,14S,18S)-7-[(2S)-butan-2-yl]-14-(4,4-dichloropentyl)-15,15-dimethyl-18-propan-2-yl-13,17-dioxa-9,20-dithia-3,6,22,23-tetrazatricyclo[17.2.1.18,11]tricosa-1(21),8(23),10,19(22)-tetraene-2,5,12,16-tetrone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215699

Download this concept:

RDF/XML TURTLE JSON-LD