skip to main content

Chemistry, part 2

Content language

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

Concept information

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

Preferred term

mangiterpene c  

Type

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

Broader concept

charge

  • 0

formula

  • C22H32O6

inchi

  • InChI=1S/C22H32O6/c1-12-13-6-9-21(4,27)15(13)11-22(14(12)7-8-20(2,3)26)18(24)16(23)10-17(28-5)19(22)25/h7-8,14-17,23,26-27H,6,9-11H2,1-5H3/b8-7+/t14-,15-,16+,17-,21+,22-/m0/s1

inchikey

  • LBWRINOPVWWCON-ZRPWVGODSA-N

mass

  • 392.492

monoisotopicmass

  • 392.21989

smiles

  • O=C1[C@]2(C(=O)[C@H](O)C[C@@H]1OC)[C@H](C(=C3CC[C@]([C@H]3C2)(O)C)C)/C=C/C(O)(C)C

subset

  • 2_STAR

synonym EXACT

  • (3R,3aS,4'R,5S,6S,6'S)-3,4'-dihydroxy-6-[(E)-3-hydroxy-3-methylbut-1-enyl]-6'-methoxy-3,7-dimethylspiro[2,3a,4,6-tetrahydro-1H-indene-5,2'-cyclohexane]-1',3'-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227768

Download this concept:

RDF/XML TURTLE JSON-LD