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 > diterpenoid > neosarcodonin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > neosarcodonin a

Preferred term

neosarcodonin a  

Type

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

Broader concept

charge

  • 0

formula

  • C21H32O4

inchi

  • InChI=1S/C21H32O4/c1-13(11-22)15-7-8-20(2)9-10-21(3)16(17(15)20)6-5-14(12-23)18(25-4)19(21)24/h5,12-13,16,18-19,22,24H,6-11H2,1-4H3/t13?,16-,18+,19+,20-,21-/m1/s1

inchikey

  • KIJQNYNQHIZOJO-UUPRHNGRSA-N

mass

  • 348.483

monoisotopicmass

  • 348.23006

smiles

  • O=CC1=CC[C@@H]2C3=C(C(CO)C)CC[C@]3(C)CC[C@]2([C@H]([C@H]1OC)O)C

subset

  • 2_STAR

synonym EXACT

  • (3aR,5aR,6R,7S,10aR)-6-hydroxy-1-(1-hydroxypropan-2-yl)-7-methoxy-3a,5a-dimethyl-2,3,4,5,6,7,10,10a-octahydrocyclohepta[e]indene-8-carbaldehyde

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217883

Download this concept:

RDF/XML TURTLE JSON-LD