(13S,14R)-13-O-acetyl-1,8-dihydroxy-N-methylcanadine

(13<i>S</i>,14<i>R</i>)-13-<i>O</i>-acetyl-1,8-dihydroxy-<i>N</i>-methylcanadine




Chemical Formula:
C23H26NO8
Molecular Weight:
444.46 Daltons
Monoisotopic Mass:
444.1658418166 Daltons
SMILES:
CC(=O)O[CH]3([CH]5(C1(C(=CC2(OCOC(C(O)=1)=2))CC[N+](C(O)C4(C(=C(OC)C=CC3=4)OC))(C)5)))
InChI:
1S/C23H25NO8/c1-11(25)32-20-13-5-6-14(28-3)21(29-4)17(13)23(27)24(2)8-7-12-9-15-22(31-10-30-15)19(26)16(12)18(20)24/h5-6,9,18,20,23,27H,7-8,10H2,1-4H3/p+1/t18-,20+,23?,24?/m1/s1
InChIKey:
ZMVJJIWEZXWPAJ-DIOGXUQJSA-O

Databases
MetaCyc:  CPD-14830
PubChem (CID):  90658685 129011757
MetaNetX:  MNXM114453
ChEBI:  141642
KEGG:  C21589