CHEBI:80085 - Lankacidin C

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ChEBI Name Lankacidin C
ChEBI ID CHEBI:80085
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C25H33NO7
Net Charge 0
Average Mass 459.53200
Monoisotopic Mass 459.22570
InChI InChI=1S/C25H33NO7/c1-14-6-9-18(28)10-8-15(2)12-21(26-23(31)17(4)27)25(5)22(30)16(3)20(33-24(25)32)13-19(29)11-7-14/h6-8,10-12,16,18-21,28-29H,9,13H2,1-5H3,(H,26,31)/b10-8+,11-7+,14-6+,15-12+/t16-,18+,19-,20-,21-,25+/m1/s1
InChIKey ATDILMLBOZKFGI-JUTMVFGESA-N
SMILES C[C@@H]1[C@H]2C[C@H](O)\C=C\C(C)=C\C[C@H](O)\C=C\C(C)=C\[C@@H](NC(=O)C(C)=O)[C@](C)(C(=O)O2)C1=O
ChEBI Ontology
Outgoing Lankacidin C (CHEBI:80085) is a organic molecular entity (CHEBI:50860)
Manual Xrefs Databases
C00018701 KNApSAcK
C15758 KEGG COMPOUND
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