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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 > (2xi,3xi)-2,3-dihydroxy-12,18-ursadien-28-oic acid diacetate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > (2xi,3xi)-2,3-dihydroxy-12,18-ursadien-28-oic acid diacetate

Preferred term

(2xi,3xi)-2,3-dihydroxy-12,18-ursadien-28-oic acid diacetate  

Type

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

Broader concept

charge

  • 0

formula

  • C34H50O6

inchi

  • InChI=1S/C34H50O6/c1-19-12-15-34(29(37)38)17-16-32(8)23(27(34)20(19)2)10-11-26-31(7)18-24(39-21(3)35)28(40-22(4)36)30(5,6)25(31)13-14-33(26,32)9/h10,19,24-26,28H,11-18H2,1-9H3,(H,37,38)

inchikey

  • NKUPBVVFDCQLGE-UHFFFAOYSA-N

mass

  • 554.768

monoisotopicmass

  • 554.36074

smiles

  • O(C1C(C2C(C3C(C4(C(=CC3)C=5C(CC4)(CCC(C5C)C)C(O)=O)C)(CC2)C)(CC1OC(=O)C)C)(C)C)C(=O)C

subset

  • 2_STAR

synonym EXACT

  • 10,11-diacetyloxy-1,2,6a,6b,9,9,12a-heptamethyl-3,4,5,6,6a,7,8,8a,10,11,12,13-dodecahydro-2H-picene-4a-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:176042

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