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Chemistry, part 1

Content language

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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 > flavonoids > flavonoid > anthocyanin > malvidin 3-glucoside-4-vinylsyringol
... > chemical entity > molecular entity > ion > cation > organic cation > anthocyanin > malvidin 3-glucoside-4-vinylsyringol
... > chemical entity > molecular entity > ion > organic ion > organic cation > anthocyanin > malvidin 3-glucoside-4-vinylsyringol
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic ion > organic cation > anthocyanin > malvidin 3-glucoside-4-vinylsyringol

Preferred term

malvidin 3-glucoside-4-vinylsyringol  

Type

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

Broader concept

charge

  • +1

formula

  • C33H33O15

inchi

  • InChI=1S/C33H32O15/c1-41-20-5-13(6-21(42-2)26(20)36)17-11-16-25-18(45-17)9-15(35)10-19(25)46-31(14-7-22(43-3)27(37)23(8-14)44-4)32(16)48-33-30(40)29(39)28(38)24(12-34)47-33/h5-11,24,28-30,33-34,36-40H,12H2,1-4H3/p+1/t24-,28-,29?,30?,33+/m1/s1

inchikey

  • VXMOAIJKHIEAAH-RWUOGCFOSA-O

mass

  • 669.611

monoisotopicmass

  • 669.18140

smiles

  • O1[C@@H]([C@@H](O)C(O)C(O)[C@@H]1OC=2C3=C4C(OC2C5=CC(OC)=C(O)C(OC)=C5)=CC(=[OH+])C=C4OC(=C3)C6=CC(OC)=C(O)C(=C6)OC)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:147414

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