codeinone

Chemical Formula:

C₁₈H₂₀NO₃

Molecular Weight:

298.361 Daltons

Monoisotopic Mass:

298.1443185135 Daltons

SMILES:

C[N+]4(CCC35(C1(C(=O)C=C[CH](C(CC2(C=CC(OC)=C(O1)C=23))4)5)))

InChI:

1S/C18H19NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-12,17H,7-9H2,1-2H3/p+1/t11-,12+,17-,18-/m0/s1

InChIKey:

XYYVYLMBEZUESM-CMKMFDCUSA-O

Databases

MetaCyc: CODEINONE

MetaboLights: MTBLC18399

PubChem (CID): 25244106 25200740

ChEBI: 18399 58473

KEGG: C06171

NCI: 631618

Seed: cpd03681

MetaNetX: MNXM114188