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homoplatensimide A

Go to external page http://purl.obolibrary.org/obo/CHEBI_68247

A polycyclic cage compound isolated from Streptomyces platensis.

Term info

Label

homoplatensimide A

Synonyms
  • N(2)-{(2E)-5-[(1S,4aS,6S,7S,9S,9aR)-1,6-dimethyl-2-oxo-1,2,5,6,7,8,9,9a-octahydro-6,9-epoxy-4a,7-methanobenzo[7]annulen-1-yl]-2-methylpent-2-enoyl}-L-glutamine
database cross reference
Subsets

3_STAR

IUPAC NAME
N(2)-{(2E)-5-[(1S,4aS,6S,7S,9S,9aR)-1,6-dimethyl-2-oxo-1,2,5,6,7,8,9,9a-octahydro-6,9-epoxy-4a,7-methanobenzo[7]annulen-1-yl]-2-methylpent-2-enoyl}-L-glutamine [ IUPAC ]

charge

0

formula

C25H34N2O6

has obo namespace

chebi_ontology

id

CHEBI:68247

inchi

InChI=1S/C25H34N2O6/c1-14(21(30)27-16(22(31)32)6-7-19(26)29)5-4-9-23(2)18(28)8-10-25-12-15-11-17(20(23)25)33-24(15,3)13-25/h5,8,10,15-17,20H,4,6-7,9,11-13H2,1-3H3,(H2,26,29)(H,27,30)(H,31,32)/b14-5+/t15-,16+,17+,20+,23-,24+,25+/m1/s1

inchikey

LSLTZMQPHAAWAW-XJYCCHPDSA-N

mass

458.54730

monoisotopicmass

458.24169

smiles

[H][C@]12C[C@]3([H])O[C@@]1(C)C[C@@]1(C2)C=CC(=O)[C@@](C)(CC\C=C(/C)C(=O)N[C@@H](CCC(N)=O)C(O)=O)[C@]31[H]