THEBAINONE ,467-98-1 _Chemical Cloud Database

THEBAINONE

Basic Information
Product Name：	THEBAINONE
CAS：	467-98-1
English Synonyms：	7,8-DIDEHYDRO-4-HYDROXY-3-METHOXY-17-METHYLMORPHINAN-6-ONE ; THEBAINONE A ; THEBAINONE
MDL Number.：	MFCD02094292
H bond acceptor：	4
H bond donor：	1
Smile：	CN1CC[C@]23CC(=O)C=C[C@H]2[C@H]1Cc4c3c(c(cc4)OC)O
InChi：	InChI=1S/C18H21NO3/c1-19-8-7-18-10-12(20)4-5-13(18)14(19)9-11-3-6-15(22-2)17(21)16(11)18/h3-6,13-14,21H,7-10H2,1-2H3/t13-,14+,18-/m0/s1
InChiKey：	InChIKey=SLJDAVMWFVYEFI-IYOUNJFTSA-N
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