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Chemistry, part 2

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 > isoprenoid > terpenoid > triterpenoid > 2-o-protocatechuoylalphitolic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > 2-o-protocatechuoylalphitolic acid

Preferred term

2-o-protocatechuoylalphitolic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C37H52O7

inchi

  • InChI=1S/C37H52O7/c1-20(2)22-12-15-37(32(42)43)17-16-35(6)23(29(22)37)9-11-28-34(5)19-26(44-31(41)21-8-10-24(38)25(39)18-21)30(40)33(3,4)27(34)13-14-36(28,35)7/h8,10,18,22-23,26-30,38-40H,1,9,11-17,19H2,2-7H3,(H,42,43)

inchikey

  • MKDOBXUKRMFQNI-UHFFFAOYSA-N

mass

  • 608.816

monoisotopicmass

  • 608.37130

smiles

  • O(C1CC2(C3C(C4(C(C5C(CC4)(CCC5C(C)=C)C(O)=O)CC3)C)(CCC2C(C1O)(C)C)C)C)C(=O)C6=CC(O)=C(O)C=C6

subset

  • 2_STAR

synonym EXACT

  • 10-(3,4-dihydroxybenzoyl)oxy-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:190857

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