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platensin A4

Go to external page http://purl.obolibrary.org/obo/CHEBI_68255

A polycyclic cage that is the 3-hydroxy derivative of platencin. It is isolated from Streptomyces platensis.

Term info

Label

platensin A4

Synonyms
  • 2,4-dihydroxy-3-({3-[(2S,3R,4aS,8S,8aR)-3-hydroxy-3,8-dimethyl-7-oxo-1,3,4,7,8,8a-hexahydro-2H-2,4a-ethanonaphthalen-8-yl]propanoyl}amino)benzoic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
2,4-dihydroxy-3-({3-[(2S,3R,4aS,8S,8aR)-3-hydroxy-3,8-dimethyl-7-oxo-1,3,4,7,8,8a-hexahydro-2H-2,4a-ethanonaphthalen-8-yl]propanoyl}amino)benzoic acid [ IUPAC ]

charge

0

formula

C24H29NO7

has obo namespace

chebi_ontology

id

CHEBI:68255

inchi

InChI=1S/C24H29NO7/c1-22(8-7-18(28)25-19-15(26)4-3-14(20(19)29)21(30)31)16-11-13-5-9-24(16,10-6-17(22)27)12-23(13,2)32/h3-4,6,10,13,16,26,29,32H,5,7-9,11-12H2,1-2H3,(H,25,28)(H,30,31)/t13-,16-,22-,23+,24+/m0/s1

inchikey

PNAZDWJMYGFNNJ-NAXDPANMSA-N

mass

443.48960

monoisotopicmass

443.19440

smiles

[H][C@@]12CC[C@]3(C[C@@]1(C)O)C=CC(=O)[C@@](C)(CCC(=O)Nc1c(O)ccc(C(O)=O)c1O)[C@]3([H])C2