CHEBI:212368 - Cangumycin D

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 Cangumycin D
ChEBI ID CHEBI:212368
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H20O7
Net Charge 0
Average Mass 360.362
Monoisotopic Mass 360.12090
InChI InChI=1S/C19H20O7/c1-8-5-9-7-13(22)18(25)17(24)14-10(3-2-4-11(14)20)16(23)19(18,26)15(9)12(21)6-8/h2-4,8,13,17,20,22,24-26H,5-7H2,1H3/t8-,13+,17-,18-,19-/m0/s1
InChIKey DYXCNZVUFZFVQI-FEIKLROSSA-N
SMILES O=C1C2=C(C(O)=CC=C2)[C@H](O)[C@@]3([C@]1(O)C=4C(=O)C[C@@H](C)CC4C[C@H]3O)O
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: DOI
ChEBI Ontology
Outgoing Cangumycin D (CHEBI:212368) is a tetralins (CHEBI:36786)
IUPAC Name
(3S,6R,6aS,7S,12aR)-6,6a,7,8,12a-pentahydroxy-3-methyl-2,3,4,5,6,7-hexahydrobenzo[a]anthracene-1,12-dione