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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 > isoprenoid > terpenoid > sesquiterpenoid > phomopsterone b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > phomopsterone b

Preferred term

phomopsterone b  

Type

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

Broader concept

charge

  • 0

formula

  • C29H42O3

inchi

  • InChI=1S/C29H42O3/c1-17(2)20(5)18(3)14-19(4)22-8-9-26(32)29-16-24(31)23-15-21(30)10-12-27(23,6)25(29)11-13-28(22,29)7/h14-15,17,19-20,22,25H,8-13,16H2,1-7H3/t19-,20-,22-,25-,27+,28-,29+/m1/s1

inchikey

  • BVMOANOTEXFTJU-TZBVVVHISA-N

mass

  • 438.652

monoisotopicmass

  • 438.31340

smiles

  • O=C1C2=CC(=O)CC[C@@]2([C@H]3CC[C@]4([C@]3(C1)C(=O)CC[C@@H]4[C@@H](C=C([C@@H](C(C)C)C)C)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,9R,10R,13R,14R)-9,13-dimethyl-14-[(2R,5R)-4,5,6-trimethylhept-3-en-2-yl]tetracyclo[8.7.0.01,13.04,9]heptadec-4-ene-3,6,17-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:216299

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