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CHEBI:200655 - Saccharosacrin D

ChEBI IDCHEBI:200655
ChEBI NameSaccharosacrin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC67H101NO19
Net Charge0
Average Mass1224.533
Monoisotopic Mass1223.69678
SMILESCCC1C=CC2/C=C(\C)C(OC3CC(C)(O)C(NC(C)=O)C(C)O3)C(C)/C=C(\C)C3C=CC4C(OC5CCC(OC6CC(OC7CCC(O)C(C)O7)C(OC7CC(O)C(O)C(C)O7)C(C)O6)C(C)O5)C(C)CC(C)C4C3(C)C(O)=C3C(=O)OC2(C1)C3=O
InChIInChI=1S/C67H101NO19/c1-15-42-16-17-43-26-35(6)58(86-54-30-65(13,76)61(40(11)81-54)68-41(12)69)33(4)24-31(2)45-19-18-44-56(66(45,14)62(73)55-63(74)67(43,29-42)87-64(55)75)32(3)25-34(5)59(44)84-51-23-21-48(37(8)78-51)82-53-28-49(83-50-22-20-46(70)36(7)77-50)60(39(10)80-53)85-52-27-47(71)57(72)38(9)79-52/h16-19,24,26,32-34,36-40,42-54,56-61,70-73,76H,15,20-23,25,27-30H2,1-14H3,(H,68,69)/b31-24+,35-26+,62-55?
InChIKeyFEGHOCVLQWUBQZ-VWXMVECCSA-N
Species of MetaboliteComponentSourceComments
Saccharothrix (ncbitaxon:2071) - PubMed (9099220)
ChEBI Ontology
Outgoing Relation(s)
Saccharosacrin D (CHEBI:200655) is a sesterterpenoid (CHEBI:26660)
IUPAC Name 
N-[6-[[(7E,11E)-17-[5-[5-(4,5-dihydroxy-6-methyloxan-2-yl)oxy-4-(5-hydroxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-3-ethyl-23-hydroxy-8,10,12,18,20,22-hexamethyl-25,27-dioxo-26-oxapentacyclo[22.2.1.01,6.013,22.016,21]heptacosa-4,7,11,14,23-pentaen-9-yl]oxy]-4-hydroxy-2,4-dimethyloxan-3-yl]acetamide