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CHEBI:200095 - A2315A

ChEBI IDCHEBI:200095
ChEBI NameA2315A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H37N3O7
Net Charge0
Average Mass503.596
Monoisotopic Mass503.26315
SMILESCC1=C\[C@@H](O)C[C@H](O)Cc2nc(co2)C(=O)N[C@H](C)C(=O)O[C@H](C(C)C)[C@H](C)/C=C/C(=O)NC\C=C\1
InChIInChI=1S/C26H37N3O7/c1-15(2)24-17(4)8-9-22(32)27-10-6-7-16(3)11-19(30)12-20(31)13-23-29-21(14-35-23)25(33)28-18(5)26(34)36-24/h6-9,11,14-15,17-20,24,30-31H,10,12-13H2,1-5H3,(H,27,32)(H,28,33)/b7-6+,9-8+,16-11+/t17-,18-,19-,20+,24-/m1/s1
InChIKeySAQNYTQFLPVTNJ-WWUMGCNISA-N
Species of MetaboliteComponentSourceComments
Actinoplanes philippinensis (ncbitaxon:35752) - PubMed (405354)
ChEBI Ontology
Outgoing Relation(s)
A2315A (CHEBI:200095) is a lactam (CHEBI:24995)
A2315A (CHEBI:200095) is a macrolide (CHEBI:25106)
IUPAC Name 
(4R,7R,8R,9E,14E,16E,18S,20S)-18,20-dihydroxy-4,8,16-trimethyl-7-propan-2-yl-6,23-dioxa-3,12,25-triazabicyclo[20.2.1]pentacosa-1(24),9,14,16,22(25)-pentaene-2,5,11-trione
Manual XrefsDatabases
10222382ChemSpider