Feedback

thebaine

Properties
MNX_IDMNXM2564
formulaC19H22NO3
charge1
mass312.38292
referencechebi:59953
Image of MNXM2564
InChIKeyFQXXSQDCDRQNQE-VMDGZTHMSA-O
InChIInChI=1S/C19H21NO3/c1-20-9-8-19-12-5-7-15(22-3)18(19)23-17-14(21-2)6-4-11(16(17)19)10-13(12)20/h4-7,13,18H,8-10H2,1-3H3/p+1/t13-,18+,19+/m1/s1
SMILESCOC1=CC=C2[C@H]3Cc4ccc(OC)c5O[C@@H]1[C@]2(CC[NH+]3C)c45

Occurences in reactions

#reac
Distinct reactions in my sandbox 0
Distinct generic reactions in MNXref7
Distinct compatimentalized reactions in models0

Similar chemical compounds in external resources
IdentifierDescription
keggC:M_C06173
seedM:M_cpd03683
secondary/obsolete/fantasy identifier
seedM:cpd03683 Thebaine
thebaine
chebi:9519 thebaine
(5R,9R,13S)-4,5-epoxy-3,6-dimethoxy-9alpha-methyl-6,8-morphinadien
(5alpha)-6,7,8,14-tetradehydro-4,5-epoxy-3,6-dimethoxy-17-methylmorphinan
3,6-dimethoxy-17-methyl-6,7,8,14-tetradehydro-4,5alpha-epoxymorphinan
3-O-methyl-oripavin
4,5alpha-epoxy-3,6-dimethoxy-17-methyl-6,8-morphinadien
Thebaine
paramorphine
chebi:59953 thebaine
3,6-dimethoxy-17-methyl-6,7,8,14-tetradehydro-4,5alpha-epoxymorphinan-17-ium
thebaine(1+)
metacycM:CPD-7710 thebaine
keggC:C06173 Thebaine