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Concept information

Preferred term

resinacein d  

Type

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

Broader concept

charge

  • 0

formula

  • C30H46O5

inchi

  • InChI=1S/C30H46O5/c1-17(9-8-10-18(2)26(34)35)19-11-14-29(6)25-20(31)15-22-27(3,4)23(33)12-13-28(22,5)24(25)21(32)16-30(19,29)7/h10,17,19,21-23,32-33H,8-9,11-16H2,1-7H3,(H,34,35)/b18-10+/t17-,19?,21-,22?,23+,28+,29+,30-/m1/s1

inchikey

  • QBAAQLPBKJNUHF-YOZTVSFCSA-N

mass

  • 486.693

monoisotopicmass

  • 486.33452

smiles

  • O=C1C2=C([C@]3(CC[C@@H](C(C3C1)(C)C)O)C)[C@H](O)C[C@]4([C@]2(CCC4[C@@H](CC/C=C(/C(=O)O)/C)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (E,6R)-6-[(3S,10S,11R,13R,14R)-3,11-dihydroxy-4,4,10,13,14-pentamethyl-7-oxo-1,2,3,5,6,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215521

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