CHEBI:214757 - Spiroxin C

ChEBI IDCHEBI:214757
ChEBI NameSpiroxin C
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SubmitterMetaboLights
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FormulaC20H10O7
Net Charge0
Average Mass362.293
Monoisotopic Mass362.04265
SMILESO=C1c2c(O)ccc3c2[C@@]2(Oc4cccc5c4[C@]3(O2)[C@@H]2O[C@@H]2C5=O)[C@@H]2O[C@H]12
InChIInChI=1S/C20H10O7/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/h1-5,15-18,21H/t15-,16-,17-,18-,19+,20+/m1/s1
InChIKeyBDSQKHZPTKUTGL-YRYYUTHUSA-N
ChEBI Ontology
Outgoing Relation(s)
Spiroxin C (CHEBI:214757) is a dibenzooxazepine (CHEBI:53802)
IUPAC Name 
(1S,2R,4S,12S,13R,15S)-18-hydroxy-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)-hexaene-5,16-dione
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