CHEBI:4044 - Cypripedin

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ChEBI Name Cypripedin
ChEBI ID CHEBI:4044
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C16H12O5
Net Charge 0
Average Mass 284.264
Monoisotopic Mass 284.06847
InChI InChI=1S/C16H12O5/c1-20-13-7-12(18)14-8-5-6-11(17)16(21-2)9(8)3-4-10(14)15(13)19/h3-7,17H,1-2H3
InChIKey BMYGDZTYQFCHKI-UHFFFAOYSA-N
SMILES COC1=CC(=O)c2c(ccc3c(OC)c(O)ccc23)C1=O
Roles Classification
Biological Role(s): xenobiotic
A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
(via phenanthrenes )
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ChEBI Ontology
Outgoing Cypripedin (CHEBI:4044) is a phenanthrol (CHEBI:25962)
Synonym Source
Cypripedin KEGG COMPOUND
Manual Xrefs Databases
C00002812 KNApSAcK
C10323 KEGG COMPOUND
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Registry Number Type Source
8031-72-9 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014