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ikarugamycin

Go to external page http://purl.obolibrary.org/obo/CHEBI_75276

A polyketide macrolactam containing a tetramic acid (pyrrolidine-2,4-dione) ring system. It is isolated from Streptomyces as an antibitoic with antiprotozoal and cytotoxic activities.

Term info

Label

ikarugamycin

Synonyms
  • (2R,3R,3aS,5aR,5bR,7Z,14S,19E,20aR,21aR,21bR)-3-ethyl-22-hydroxy-2-methyl-2,3,3a,5a,5b,6,10,11,12,13,14,15,20a,21,21a,21b-hexadecahydro-1H-14,17-(metheno)-as-indaceno[3,2-k][1,6]diazacycloheptadecine-9,16,18(17H)-trione
database cross reference
Subsets

3_STAR

IUPAC NAME
(2R,3R,3aS,5aR,5bR,7Z,14S,19E,20aR,21aR,21bR)-3-ethyl-22-hydroxy-2-methyl-2,3,3a,5a,5b,6,10,11,12,13,14,15,20a,21,21a,21b-hexadecahydro-1H-14,17-(metheno)-as-indaceno[3,2-k][1,6]diazacycloheptadecine-9,16,18(17H)-trione [ IUPAC ]

charge

0

formula

C29H38N2O4

has obo namespace

chebi_ontology

id

CHEBI:75276

inchi

InChI=1S/C29H38N2O4/c1-3-18-16(2)14-22-20(18)10-11-21-19-6-4-8-26(33)30-13-5-7-24-28(34)27(29(35)31-24)25(32)12-9-17(19)15-23(21)22/h4,8-12,16-24,34H,3,5-7,13-15H2,1-2H3,(H,30,33)(H,31,35)/b8-4-,12-9+/t16-,17+,18-,19-,20+,21-,22+,23+,24+/m1/s1

inchikey

WSUGGLXIPUHOSG-KTVMMZQWSA-N

mass

478.62300

monoisotopicmass

478.28316

smiles

[H][C@@]12CCCNC(=O)\C=C/C[C@]3([H])[C@]([H])(C[C@]4([H])[C@@]5([H])C[C@@H](C)[C@@H](CC)[C@]5([H])C=C[C@]34[H])\C=C\C(=O)C(C(=O)N1)=C2O