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Concept information

Preferred term

دوداوالامید دی  

Type

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

charge

  • 0

formula

  • C44H65N5O9

inchi

  • InChI=1S/C44H65N5O9/c1-12-14-16-23-33-44(8,9)43(56)46-35(27(3)4)40(53)48(11)36(28(5)6)42(55)58-37(29(7)13-2)41(54)49-24-19-22-31(49)39(52)47(10)32(25-30-20-17-15-18-21-30)38(51)45-26-34(50)57-33/h1,15,17-18,20-21,27-29,31-33,35-37H,13-14,16,19,22-26H2,2-11H3,(H,45,51)(H,46,56)/t29-,31-,32-,33-,35-,36-,37+/m0/s1

inchikey

  • YHMPIYZQVBVDCW-UKQDKWHSSA-N

mass

  • 808.030

monoisotopicmass

  • 807.47823

smiles

  • O=C1N[C@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N2[C@@H](CCC2)C(N([C@H](C(NCC(O[C@H](C1(C)C)CCCC#C)=O)=O)CC3=CC=CC=C3)C)=O)[C@H](CC)C)C(C)C)C)C(C)C

subset

  • 2_STAR

synonym EXACT

  • (3R,6S,9S,13S,19S,22S)-19-benzyl-3-[(2S)-butan-2-yl]-7,12,12,20-tetramethyl-13-pent-4-ynyl-6,9-di(propan-2-yl)-4,14-dioxa-1,7,10,17,20-pentazabicyclo[20.3.0]pentacosane-2,5,8,11,15,18,21-heptone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:207855

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