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Concept information

Preferred term

alachalasin d  

Type

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

Broader concept

charge

  • 0

formula

  • C22H31NO5

inchi

  • InChI=1S/C22H31NO5/c1-10-7-6-8-14-18(26)12(3)11(2)17-13(4)23-20(27)22(14,17)16(25)9-15(24)21(5)19(10)28-21/h6,8,10-11,13-15,17-19,24,26H,3,7,9H2,1-2,4-5H3,(H,23,27)/b8-6+/t10-,11+,13-,14-,15-,17-,18+,19+,21-,22+/m0/s1

inchikey

  • JLIGZLZPWHFDND-WTFXJYTMSA-N

mass

  • 389.492

monoisotopicmass

  • 389.22022

smiles

  • O=C1[C@@]23C(=O)N[C@H]([C@@H]2[C@H](C)C([C@H]([C@@H]3C=CC[C@@H]([C@@H]4[C@]([C@H](C1)O)(O4)C)C)O)=C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,4S,5S,7R,8S,10E,12R,13S,15S,16R,17S)-4,13-dihydroxy-5,8,15,17-tetramethyl-14-methylidene-6-oxa-18-azatetracyclo[10.7.0.01,16.05,7]nonadec-10-ene-2,19-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:213033

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