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Concept information

Preferred term

terreusterpene c  

Type

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

Broader concept

charge

  • 0

formula

  • C26H36O9

inchi

  • InChI=1S/C26H36O9/c1-12-11-13-22(4)10-9-14(27)21(2,3)16(22)15(28)18(29)23(13,5)17-19(30)35-26(33,24(12,17)6)25(7,32)20(31)34-8/h13,16-18,29,32-33H,1,9-11H2,2-8H3/t13-,16+,17-,18+,22-,23-,24+,25+,26?/m0/s1

inchikey

  • RNHOYPKKIMFLPG-HBYVPZLSSA-N

mass

  • 492.565

monoisotopicmass

  • 492.23593

smiles

  • O=C1[C@@H](O)[C@]2([C@@H](CC(=C)[C@@]3([C@H]2C(=O)OC3(O)[C@](O)(C(=O)OC)C)C)[C@]4([C@H]1C(C(=O)CC4)(C)C)C)C

subset

  • 2_STAR

synonym EXACT

  • methyl (2S)-2-[(3aS,3bS,4S,5aS,9aS,9bS,11aS)-1,4-dihydroxy-3b,6,6,9a,11a-pentamethyl-11-methylidene-3,5,7-trioxo-4,5a,8,9,9b,10-hexahydro-3aH-naphtho[2,1-e][2]benzouran-1-yl]-2-hydroxypropanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215739

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