skip to main content

Content language

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

Concept information

Preferred term

tmc-1c  

Type

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

charge

  • 0

formula

  • C30H38N2O7

inchi

  • InChI=1S/C30H38N2O7/c1-4-5-10-20(2)17-21(3)12-15-28(38)31-22-19-30(39,26(36)18-25(22)35)16-9-7-6-8-11-27(37)32-29-23(33)13-14-24(29)34/h6-9,11-12,15-17,19-20,26,33,36,39H,4-5,10,13-14,18H2,1-3H3,(H,31,38)(H,32,37)/b7-6+,11-8+,15-12+,16-9+,21-17+/t20?,26-,30+/m1/s1

inchikey

  • WDPVYGCEBGDANZ-CXLBDHTJSA-N

mass

  • 538.63190

monoisotopicmass

  • 538.26790

smiles

  • CCCCC(C)/C=C(C)/C=C/C(=O)NC1=C[C@@](O)(/C=C/C=C/C=C/C(=O)NC2=C(O)CCC2=O)[C@H](O)CC1=O

subset

  • 3_STAR

synonym EXACT

  • (2E,4E)-N-[(3S,4R)-3,4-dihydroxy-3-[(1E,3E,5E)-7-[(2-hydroxy-5-oxocyclopent-1-en-1-yl)amino]-7-oxohepta-1,3,5-trienyl]-6-oxocyclohex-1-en-1-yl]-4,6-dimethyldeca-2,4-dienamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:66236

Download this concept: