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

Preferred term

inonotusane c  

Type

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

Broader concept

charge

  • 0

formula

  • C27H42O2

inchi

  • InChI=1S/C27H42O2/c1-18(8-7-17-28)19-11-15-27(6)21-9-10-22-24(2,3)23(29)13-14-25(22,4)20(21)12-16-26(19,27)5/h7-8,17-19,22-23,29H,9-16H2,1-6H3/b8-7+/t18-,19-,22+,23+,25-,26-,27+/m1/s1

inchikey

  • FFAHKEMMBZQSGI-BYIYCMQOSA-N

mass

  • 398.631

monoisotopicmass

  • 398.31848

smiles

  • O=C/C=C/[C@H]([C@@H]1[C@@]2([C@@](C3=C([C@@]4([C@H](C([C@@H](O)CC4)(C)C)CC3)C)CC2)(C)CC1)C)C

subset

  • 2_STAR

synonym EXACT

  • (E,4R)-4-[(3S,5R,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]pent-2-enal

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:200056

Download this concept:

RDF/XML TURTLE JSON-LD