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CHEBI:200639 - Steffimycin C

ChEBI IDCHEBI:200639
ChEBI NameSteffimycin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H34O15
Net Charge0
Average Mass622.576
Monoisotopic Mass622.18977
SMILESCOc1cc(O)c2c(c1)C(=O)c1c(O)c3c(c(O)c1C2=O)[C@@H](O[C@@H]1O[C@@H](C)[C@H](OC)[C@@H](O)[C@H]1OC)[C@H](OC)[C@](C)(O)C3(O)O
InChIInChI=1S/C29H34O15/c1-9-23(40-4)22(35)25(41-5)27(43-9)44-24-16-17(29(37,38)28(2,36)26(24)42-6)21(34)14-15(20(16)33)19(32)13-11(18(14)31)7-10(39-3)8-12(13)30/h7-9,22-27,30,33-38H,1-6H3/t9-,22+,23-,24+,25+,26-,27-,28-/m0/s1
InChIKeyIZQVNZLLMTWQNY-CPNBUFMXSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - DOI (10.1016/j.tetlet.2015.10.098)
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Steffimycin C (CHEBI:200639) is a anthracycline (CHEBI:48120)
IUPAC Name 
(7R,8S,9S)-4,6,9,10,10,11-hexahydroxy-7-[(2S,3R,4R,5R,6S)-4-hydroxy-3,5-dimethoxy-6-methyloxan-2-yl]oxy-2,8-dimethoxy-9-methyl-7,8-dihydrotetracene-5,12-dione
Manual XrefsDatabases
78436643ChemSpider