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Chemistry, part 2

Content language

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Concept information

... > organooxygen compound > ester > carboxylic ester > lactone > gamma-lactone > gemmacolide g, (rel)-
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > gamma-lactone > gemmacolide g, (rel)-
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > gamma-lactone > gemmacolide g, (rel)-
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > gamma-lactone > gemmacolide g, (rel)-
organooxygen compound > ester > lactone > gamma-lactone > gemmacolide g, (rel)-
organooxygen compound > oxacycle > lactone > gamma-lactone > gemmacolide g, (rel)-
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > gamma-lactone > gemmacolide g, (rel)-
... > 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 heterocyclic compound > oxacycle > lactone > gamma-lactone > gemmacolide g, (rel)-
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > gamma-lactone > gemmacolide g, (rel)-

Preferred term

gemmacolide g, (rel)-  

Type

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

Broader concept

charge

  • 0

formula

  • C30H37ClO14

has_role

inchi

  • InChI=1S/C30H37ClO14/c1-12-9-10-19(40-14(3)32)28(8)22(26(44-18(7)36)30(38)13(2)27(37)45-23(30)20(12)31)29(11-39-29)25(43-17(6)35)21(41-15(4)33)24(28)42-16(5)34/h9-10,13,19-26,38H,1,11H2,2-8H3/b10-9+/t13-,19-,20-,21+,22+,23-,24-,25+,26-,28+,29-,30-/m0/s1

inchikey

  • CMKNGEIJCJJGAQ-DFOHHMFPSA-N

mass

  • 657.05900

monoisotopicmass

  • 656.18718

smiles

  • [H][C@@]12OC(=O)[C@H](C)[C@@]1(O)[C@@H](OC(C)=O)[C@]1([H])[C@@](C)([C@@H](OC(C)=O)/C=C/C(=C)[C@@H]2Cl)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@]11CO1

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68209

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