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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 > lsm-6319
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > lsm-6319

Preferred term

lsm-6319  

Type

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

Broader concept

charge

  • 0

formula

  • C37H48O6

inchi

  • InChI=1S/C37H48O6/c1-21(2)11-12-26(24(7)8)19-36-20-27(17-23(5)6)35(9,10)37(34(36)43,16-15-22(3)4)33(42)30(32(36)41)31(40)25-13-14-28(38)29(39)18-25/h11,13-15,17-18,26-27,38-40H,7,12,16,19-20H2,1-6,8-10H3/t26-,27+,36+,37-/m0/s1

inchikey

  • QKACJXUOZWIRSN-RSNVXJODSA-N

mass

  • 588.775

monoisotopicmass

  • 588.34509

smiles

  • CC(=CC[C@@H](C[C@]12C[C@H](C([C@](C1=O)(C(=O)C(=C(C3=CC(=C(C=C3)O)O)O)C2=O)CC=C(C)C)(C)C)C=C(C)C)C(=C)C)C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:95069

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