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platensimycin B3

Go to external page http://purl.obolibrary.org/obo/CHEBI_68245

A polycyclic cage that is the decarboxy derivative of platensimycin. It is isolated from Streptomyces platensis.

Term info

Label

platensimycin B3

Synonyms
  • N-(2,6-dihydroxyphenyl)-3-[(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]propanamide
database cross reference
Subsets

3_STAR

IUPAC NAME
N-(2,6-dihydroxyphenyl)-3-[(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]propanamide [ IUPAC ]

charge

0

formula

C23H27NO5

has obo namespace

chebi_ontology

id

CHEBI:68245

inchi

InChI=1S/C23H27NO5/c1-21(8-7-18(28)24-19-14(25)4-3-5-15(19)26)17(27)6-9-23-11-13-10-16(20(21)23)29-22(13,2)12-23/h3-6,9,13,16,20,25-26H,7-8,10-12H2,1-2H3,(H,24,28)/t13-,16+,20+,21-,22+,23+/m1/s1

inchikey

VAXBYZCUDVPKHJ-YIBOSTEYSA-N

mass

397.46420

monoisotopicmass

397.18892

smiles

[H][C@]12C[C@]3([H])O[C@@]1(C)C[C@@]1(C2)C=CC(=O)[C@@](C)(CCC(=O)Nc2c(O)cccc2O)[C@]31[H]