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

Concept information

Preferred term

colletopeptide c  

Type

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

Broader concept

charge

  • 0

formula

  • C29H46N2O6

inchi

  • InChI=1S/C29H46N2O6/c1-18(2)26-29(36)37-25(19(3)12-10-11-13-20(4)32)17-24(33)21(5)27(34)30-23(28(35)31(26)6)16-22-14-8-7-9-15-22/h7-9,14-15,18-21,23-26,32-33H,10-13,16-17H2,1-6H3,(H,30,34)/t19-,20+,21+,23+,24+,25-,26-/m0/s1

inchikey

  • UTXNSDOAIBMTMJ-ULSNTHSRSA-N

mass

  • 518.695

monoisotopicmass

  • 518.33559

smiles

  • O=C1O[C@H]([C@H](CCCC[C@H](O)C)C)C[C@@H](O)[C@H](C(=O)N[C@@H](C(N([C@H]1C(C)C)C)=O)CC2=CC=CC=C2)C

subset

  • 2_STAR

synonym EXACT

  • (3S,6R,9R,10R,12S)-6-benzyl-10-hydroxy-12-[(2S,7R)-7-hydroxyoctan-2-yl]-4,9-dimethyl-3-propan-2-yl-1-oxa-4,7-diazacyclododecane-2,5,8-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223991

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