8-demethyl-8-(2,3,4-O-trimethyl-alpha-L-rhamnosyl)tetracenomycin C (CHEBI:78287)

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CHEBI:78287 - 8-demethyl-8-(2,3,4-O-trimethyl-α-L-rhamnosyl)tetracenomycin C

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ChEBI ID	CHEBI:78287
ChEBI Name	8-demethyl-8-(2,3,4-O-trimethyl-α-L-rhamnosyl)tetracenomycin C
Stars
ASCII Name	8-demethyl-8-(2,3,4-O-trimethyl-alpha-L-rhamnosyl)tetracenomycin C
Definition	A member of the class of tetracenomycins that is 8-demethyltetracenomycin C in which the hydroxyl hydrogen at position 8 is replaced by a 2,3,4-tri-O-methyl-α-L-rhamnosyl residue.
Last Modified	6 February 2018
Submitter	KAX
Downloads	Molfile

Formula	C31H34O15
Net Charge	0
Average Mass	646.598
Monoisotopic Mass	646.18977
SMILES	COC(=O)c1c(O[C@@H]2O[C@@H](C)[C@H](OC)[C@@H](OC)[C@H]2OC)cc2cc3c(c(O)c2c1C)C(=O)[C@]1(O)C(=O)C=C(OC)[C@@H](O)[C@]1(O)C3=O
InChI	InChI=1S/C31H34O15/c1-11-18-13(9-15(19(11)28(37)44-7)46-29-24(43-6)23(42-5)22(41-4)12(2)45-29)8-14-20(21(18)33)27(36)30(38)17(32)10-16(40-3)26(35)31(30,39)25(14)34/h8-10,12,22-24,26,29,33,35,38-39H,1-7H3/t12-,22-,23+,24+,26+,29-,30+,31+/m0/s1
InChIKey	GDMKCWSZMAFALT-WNSZSYCKSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces olivaceus (ncbitaxon:47716)	-	PubMed (11376004)

Roles Classification

Biological Role:

bacterial metabolite Any prokaryotic metabolite produced during a metabolic reaction in bacteria.

ChEBI Ontology

Outgoing Relation(s)
	8-demethyl-8-(2,3,4-O-trimethyl-α-L-rhamnosyl)tetracenomycin C (CHEBI:78287) has functional parent tetracenomycin C (CHEBI:9470)
	8-demethyl-8-(2,3,4-O-trimethyl-α-L-rhamnosyl)tetracenomycin C (CHEBI:78287) has role bacterial metabolite (CHEBI:76969)
	8-demethyl-8-(2,3,4-O-trimethyl-α-L-rhamnosyl)tetracenomycin C (CHEBI:78287) is a enol ether (CHEBI:47985)
	8-demethyl-8-(2,3,4-O-trimethyl-α-L-rhamnosyl)tetracenomycin C (CHEBI:78287) is a enone (CHEBI:51689)
	8-demethyl-8-(2,3,4-O-trimethyl-α-L-rhamnosyl)tetracenomycin C (CHEBI:78287) is a methyl ester (CHEBI:25248)
	8-demethyl-8-(2,3,4-O-trimethyl-α-L-rhamnosyl)tetracenomycin C (CHEBI:78287) is a monosaccharide derivative (CHEBI:63367)
	8-demethyl-8-(2,3,4-O-trimethyl-α-L-rhamnosyl)tetracenomycin C (CHEBI:78287) is a phenols (CHEBI:33853)
	8-demethyl-8-(2,3,4-O-trimethyl-α-L-rhamnosyl)tetracenomycin C (CHEBI:78287) is a tertiary α-hydroxy ketone (CHEBI:139592)
	8-demethyl-8-(2,3,4-O-trimethyl-α-L-rhamnosyl)tetracenomycin C (CHEBI:78287) is a tetracenequinones (CHEBI:51286)
	8-demethyl-8-(2,3,4-O-trimethyl-α-L-rhamnosyl)tetracenomycin C (CHEBI:78287) is a α-L-rhamnoside (CHEBI:27848)

IUPAC Name
methyl (6aR,7S,10aR)-3-[(6-deoxy-2,3,4-tri-O-methyl-α-L-mannopyranosyl)oxy]-6a,7,10a,12-tetrahydroxy-8-methoxy-1-methyl-6,10,11-trioxo-6,6a,7,10,10a,11-hexahydrotetracene-2-carboxylate

Synonym	Source
12-demethylelloramycin A	SUBMITTER

UniProt Name	Source
8-demethyl-8-(2,3,4-tri-O-methyl-α-L-rhamnosyl)-tetracenomycin C	UniProt

Manual Xrefs	Databases
CPD-16638	MetaCyc

Citations