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platensimycin B4

Go to external page http://purl.obolibrary.org/obo/CHEBI_68239

A monosaccharide derivative of platensimycin isolated from Streptomyces platensis.

Term info

Label

platensimycin B4

Synonyms
  • 3-({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]propanoyl}amino)-4-(beta-L-glucopyranosyloxy)-2-hydroxybenzoic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
3-({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]propanoyl}amino)-4-(beta-L-glucopyranosyloxy)-2-hydroxybenzoic acid [ IUPAC ]

charge

0

formula

C30H37NO12

has obo namespace

chebi_ontology

id

CHEBI:68239

inchi

InChI=1S/C30H37NO12/c1-28(18(33)5-8-30-10-13-9-16(25(28)30)43-29(13,2)12-30)7-6-19(34)31-20-15(4-3-14(21(20)35)26(39)40)41-27-24(38)23(37)22(36)17(11-32)42-27/h3-5,8,13,16-17,22-25,27,32,35-38H,6-7,9-12H2,1-2H3,(H,31,34)(H,39,40)/t13-,16+,17+,22+,23-,24+,25+,27+,28-,29+,30+/m1/s1

inchikey

IHNOHYIMWXMKQI-KGDOMDPMSA-N

mass

603.61430

monoisotopicmass

603.23158

smiles

[H][C@]12C[C@]3([H])O[C@@]1(C)C[C@@]1(C2)C=CC(=O)[C@@](C)(CCC(=O)Nc2c(O)c(ccc2O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)C(O)=O)[C@]31[H]