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Ancistrotectorine
SpectraBase Compound ID 9i8omQMJYFA
InChI InChI=1S/C26H31NO4/c1-14-11-17-9-8-10-19(29-5)23(17)25(28)21(14)24-20(30-6)13-18-12-15(2)27(4)16(3)22(18)26(24)31-7/h8-11,13,15-16,28H,12H2,1-7H3/t15-,16+/m0/s1
InChIKey BHQAJMGEYYHIGV-JKSUJKDBSA-N
Mol Weight 421.54 g/mol
Molecular Formula C26H31NO4
Exact Mass 421.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5txyITNJoep
Name Ancistrotectorine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H31NO4
InChI InChI=1S/C26H31NO4/c1-14-11-17-9-8-10-19(29-5)23(17)25(28)21(14)24-20(30-6)13-18-12-15(2)27(4)16(3)22(18)26(24)31-7/h8-11,13,15-16,28H,12H2,1-7H3/t15-,16+/m0/s1
InChIKey BHQAJMGEYYHIGV-JKSUJKDBSA-N
Molecular Weight 421.537 g/mol
SMILES Oc1c(-c2c(c3[C@](N(C)[C@](Cc3cc2OC)(C)[H])(C)[H])OC)c(cc2cccc(c12)OC)C
SPLASH splash10-0pb9-0920400000-2e6513e7968cd8c1f33a
Source of Spectrum X2-48-534-2
Synonyms 2-[(1R,3S)-6,8-dimethoxy-1,2,3-trimethyl-3,4-dihydro-1H-isoquinolin-7-yl]-8-methoxy-3-methyl-1-naphthalenol 2-[(1R,3S)-6,8-dimethoxy-1,2,3-trimethyl-3,4-dihydro-1H-isoquinolin-7-yl]-8-methoxy-3-methylnaphthalen-1-ol 2-[(1R,3S)-6,8-dimethoxy-1,2,3-trimethyl-3,4-dihydro-1H-isoquinolin-7-yl]-8-methoxy-3-methyl-naphthalen-1-ol
Wiley ID 1601742