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Concept information

Preferred term

14،15 irpexanoxide  

Type

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

Broader concept

charge

  • 0

formula

  • C36H62O8

inchi

  • InChI=1S/C36H62O8/c1-24(2)13-9-15-26(5)17-11-21-35(7,41)29(43-34-33(40)32(39)31(38)28(23-37)42-34)19-20-30-36(8,44-30)22-12-18-27(6)16-10-14-25(3)4/h13-14,17-18,28-34,37-41H,9-12,15-16,19-23H2,1-8H3/b26-17+,27-18+/t28-,29?,30?,31-,32+,33+,34+,35?,36?/m1/s1

inchikey

  • QBDCMLASZXKWQJ-NUMZQHTLSA-N

mass

  • 622.884

monoisotopicmass

  • 622.44447

smiles

  • O1[C@@H](OC(C(O)(CC/C=C(/CCC=C(C)C)/C)C)CCC2OC2(CC/C=C(/CCC=C(C)C)/C)C)[C@@H](O)[C@@H](O)[C@@H]([C@H]1CO)O

subset

  • 2_STAR

synonym EXACT

  • (2S,3S,4S,5S,6R)-2-[(7E)-1-[3-[(3E)-4,8-dimethylnona-3,7-dienyl]-3-methyloxiran-2-yl]-4-hydroxy-4,8,12-trimethyltrideca-7,11-dien-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:202750

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