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CHEBI:176165 - PC-M5'

ChEBI IDCHEBI:176165
ChEBI NamePC-M5'
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FormulaC29H37NO5
Net Charge0
Average Mass479.617
Monoisotopic Mass479.26717
SMILES[H][C@@]12CC[C@@]3(O)C4=C[C@@H](OC(C)=O)[C@@]([H])(C(C)(C)O)O[C@@]4([H])CC[C@]3(C)[C@@]1(C)c1nc3ccccc3c1C2
InChIInChI=1S/C29H37NO5/c1-16(31)34-23-15-20-22(35-25(23)26(2,3)32)11-12-27(4)28(5)17(10-13-29(20,27)33)14-19-18-8-6-7-9-21(18)30-24(19)28/h6-9,15,17,22-23,25,30,32-33H,10-14H2,1-5H3/t17-,22-,23+,25-,27+,28+,29+/m0/s1
InChIKeyIMABPJDBODVJSN-HKZMUHMQSA-N
ChEBI Ontology
Outgoing Relation(s)
PC-M5' (CHEBI:176165) is a organic heterotricyclic compound (CHEBI:26979)
PC-M5' (CHEBI:176165) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
[(1S,2R,5S,7S,8R,11S,14S)-11-hydroxy-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-6-oxa-23-azahexacyclo[12.10.0.02,11.05,10.016,24.017,22]tetracosa-9,16(24),17,19,21-pentaen-8-yl] acetate
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HMDB0038569HMDB
22943202ChemSpider