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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > diarylheptanoid > sanggenon e
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > diarylheptanoid > sanggenon e
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > benzenoid aromatic compound > diarylheptanoid > sanggenon e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > benzenoid aromatic compound > diarylheptanoid > sanggenon e
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > benzenoid aromatic compound > diarylheptanoid > sanggenon e
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > carbocyclic compound > benzenoid aromatic compound > diarylheptanoid > sanggenon e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > carbocyclic compound > benzenoid aromatic compound > diarylheptanoid > sanggenon e
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > carbocyclic compound > benzenoid aromatic compound > diarylheptanoid > sanggenon e

Preferred term

sanggenon e  

Type

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

Broader concept

charge

  • 0

formula

  • C45H44O12

inchi

  • InChI=1S/C45H44O12/c1-21(2)6-9-27-32(48)13-11-28(40(27)51)41(52)37-29(26-10-7-24(46)18-33(26)49)16-23(5)17-30(37)38-34(50)20-36-39(42(38)53)43(54)45(55)44(56-36,15-14-22(3)4)31-12-8-25(47)19-35(31)57-45/h6-8,10-14,17-20,29-30,37,46-51,53,55H,9,15-16H2,1-5H3/t29-,30-,37-,44+,45+/m1/s1

inchikey

  • QVHFFSLHYOWTJT-KDJZGPCZSA-N

mass

  • 776.835

monoisotopicmass

  • 776.28328

smiles

  • O1[C@@]2([C@](OC3=C2C=CC(O)=C3)(O)C(=O)C4=C1C=C(O)C([C@]5([C@@H]([C@](CC(=C5)C)(C6=C(O)C=C(O)C=C6)[H])C(=O)C7=C(O)C(=C(O)C=C7)CC=C(C)C)[H])=C4O)CC=C(C)C

subset

  • 2_STAR

synonym EXACT

  • (5aS,10aR)-2-[(1R,5S,6R)-6-[2,4-dihydroxy-3-(3-methylbut-2-enyl)benzoyl]-5-(2,4-dihydroxyphenyl)-3-methylcyclohex-2-en-1-yl]-1,3,8,10a-tetrahydroxy-5a-(3-methylbut-2-enyl)-[1]benzouro[3,2-b]chromen-11-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:190283

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