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CHEBI:220081 - Desulfoclethramycin

ChEBI IDCHEBI:220081
ChEBI NameDesulfoclethramycin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC63H99N3O15
Net Charge0
Average Mass1138.491
Monoisotopic Mass1137.70762
SMILESCC(=CC=CC=CCCC=C[C@H](C)[C@H](O)[C@@H](C)[C@H](O)C=CC=CC=CC=CC=CC=CC[C@H](O)[C@H](C)C(=O)C[C@H](O)C[C@H](O)C=CC[C@H](O)C[C@H](O)C[C@@H](O)C=CC[C@@H](O)C[C@H](O)C=CC[C@H](O)C[C@H](O)CCCN=C(N)N)C(=O)O
InChIInChI=1S/C63H99N3O15/c1-45(27-19-15-11-10-12-16-20-28-46(2)62(80)81)61(79)48(4)59(77)37-22-18-14-9-7-5-6-8-13-17-21-36-58(76)47(3)60(78)44-57(75)43-54(72)34-25-33-53(71)42-56(74)41-52(70)32-24-31-50(68)39-49(67)29-23-30-51(69)40-55(73)35-26-38-66-63(64)65/h5-10,12-14,16-25,27-29,32,34,37,45,47-59,61,67-77,79H,11,15,26,30-31,33,35-36,38-44H2,1-4H3,(H,80,81)(H4,64,65,66)/t45-,47-,48-,49+,50+,51-,52-,53-,54+,55+,56+,57+,58-,59+,61-/m0/s1
InChIKeyRPGARLRIXQBHPT-HZXPUPGVSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (24218293)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Desulfoclethramycin (CHEBI:220081) is a hydroxy fatty acid (CHEBI:24654)