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Concept information

Preferred term

پوبسنول  

Type

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

Broader concept

charge

  • 0

formula

  • C32H40O10

inchi

  • InChI=1S/C32H40O10/c1-18-14-15-30(7,8)27(37)25(39-21(4)33)16-19(2)28(40-22(5)34)32(38)29(41-24-12-10-9-11-13-24)20(3)17-31(32,26(18)36)42-23(6)35/h9-15,18,20,25,28-29,38H,2,16-17H2,1,3-8H3/b15-14+/t18-,20+,25?,28+,29+,31?,32-/m1/s1

inchikey

  • MTGQAODUFPLLOP-IAXITCCYSA-N

mass

  • 584.662

monoisotopicmass

  • 584.26215

smiles

  • O(C12[C@](O)([C@@H](OC3=CC=CC=C3)[C@H](C1)C)[C@@H](OC(=O)C)C(CC(OC(=O)C)C(=O)C(C=C[C@H](C2=O)C)(C)C)=C)C(=O)C

subset

  • 2_STAR

synonym EXACT

  • [(1S,2S,5R,6E,13S,13aS)-3a,13-diacetyloxy-13a-hydroxy-2,5,8,8-tetramethyl-12-methylidene-4,9-dioxo-1-phenoxy-2,3,5,10,11,13-hexahydro-1H-cyclopenta[12]annulen-10-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:173297

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