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CHEBI:212954 - Spiroxin D

ChEBI IDCHEBI:212954
ChEBI NameSpiroxin D
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SubmitterMetaboLights
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FormulaC20H12O7
Net Charge0
Average Mass364.309
Monoisotopic Mass364.05830
SMILESO=C1c2cccc3c2[C@]2(O[C@@]4(O3)c3c2ccc(O)c3C(O)[C@H]2O[C@H]24)[C@@H]2O[C@H]12
InChIInChI=1S/C20H12O7/c21-8-5-4-7-12-10(8)14(23)16-18(25-16)20(12)26-9-3-1-2-6-11(9)19(7,27-20)17-15(24-17)13(6)22/h1-5,14-18,21,23H/t14?,15-,16-,17-,18-,19+,20+/m1/s1
InChIKeyBGUFABJXQFLBQE-YJGJOGHXSA-N
ChEBI Ontology
Outgoing Relation(s)
Spiroxin D (CHEBI:212954) is a dibenzooxazepine (CHEBI:53802)
IUPAC Name 
(1S,2R,4S,12S,13R,15R)-16,18-dihydroxy-3,11,14,22-tetraoxaoctacyclo[10.9.1.11,6.112,17.02,4.013,15.010,24.021,23]tetracosa-6(24),7,9,17,19,21(23)-hexaen-5-one
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8559584ChemSpider