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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

verrulactone c  

Type

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

Broader concept

charge

  • 0

formula

  • C29H18O12

inchi

  • InChI=1S/C29H18O12/c1-9-4-17(33)28(29(9)11-5-10(38-2)6-12(30)18(11)27(37)41-29)23-16(39-3)7-13(31)19-21(23)20-15(40-26(19)36)8-14(32)24(34)22(20)25(28)35/h4-8,30,32,35-36H,1-3H3/t28-,29-/m0/s1

inchikey

  • JZRVHFKTEMJGIG-VMPREFPWSA-N

mass

  • 558.451

monoisotopicmass

  • 558.07983

smiles

  • O=C1C=2C=3C=4C(=C(O)OC3C=C1O)C(=O)C=C(C4[C@]5(C2O)C(=O)C=C([C@@]56OC(=O)C7=C6C=C(OC)C=C7O)C)OC

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:226559

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