CHEBI:224286 - Baraphenazine F

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Baraphenazine F
ChEBI ID CHEBI:224286
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C25H16N4O6
Net Charge 0
Average Mass 468.425
Monoisotopic Mass 468.10698
InChI InChI=1S/C25H16N4O6/c30-15-3-1-2-12-18(15)28-20-14(26-12)8-11-9-4-6-13-19(23(9)35-24(20)22(11)32)29-21-16(31)7-5-10(25(33)34)17(21)27-13/h1-7,11,22,24,30-32H,8H2,(H,33,34)/t11-,22-,24-/m1/s1
InChIKey GTOOBNVUAQLCTL-HAZYUSCYSA-N
SMILES O=C(O)C=1C2=NC=3C(=C4O[C@@H]5C6=NC7=C(O)C=CC=C7N=C6C[C@H](C4=CC3)[C@H]5O)N=C2C(O)=CC1
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing Baraphenazine F (CHEBI:224286) is a phenazines (CHEBI:39201)
IUPAC Name
(1R,17R,29R)-11,21,29-trihydroxy-16-oxa-6,13,19,26-tetrazaheptacyclo[15.11.1.02,15.05,14.07,12.018,27.020,25]nonacosa-2(15),3,5,7,9,11,13,18,20(25),21,23,26-dodecaene-8-carboxylic acid