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20-Norcrotalanan-11,15-dione, 14,19-dihydro-12-hydroxy-, (13.alpha.,14.alpha.)-
SpectraBase Compound ID 7ZtYLXHB3mh
InChI InChI=1S/C16H23NO5/c1-9-10(2)16(3,20)15(19)21-8-11-4-6-17-7-5-12(13(11)17)22-14(9)18/h4,9-10,12-13,20H,5-8H2,1-3H3/t9-,10+,12?,13?,16-/m0/s1
InChIKey QPNKYNYIKKVVQB-CJVPGBSCSA-N
Mol Weight 309.36 g/mol
Molecular Formula C16H23NO5
Exact Mass 309.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G7Pi7BoRGbT
Name 20-Norcrotalanan-11,15-dione, 14,19-dihydro-12-hydroxy-, (13.alpha.,14.alpha.)-
CAS Registry Number 120154-95-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO5
InChI InChI=1S/C16H23NO5/c1-9-10(2)16(3,20)15(19)21-8-11-4-6-17-7-5-12(13(11)17)22-14(9)18/h4,9-10,12-13,20H,5-8H2,1-3H3/t9-,10+,12?,13?,16-/m0/s1
InChIKey QPNKYNYIKKVVQB-CJVPGBSCSA-N
Molecular Weight 309.362 g/mol
SMILES O[C@]1([C@@]([C@@](C(OC2C3C(=CCN3CC2)COC1=O)=O)(C)[H])(C)[H])C
SPLASH splash10-01bi-3900000000-ed92835432e27139661d
Source of Spectrum B-41-435-2
Synonyms 2H-[1,6]Dioxacycloundecino[2,3,4-gh]pyrrolizine, 20-norcrotalanan-11,15-dione deriv. (-)-Crotaleschenine (7.beta.,8.alpha.-H,12.alpha.,13.alpha.,14.alpha.)-12.beta.-hydroxy-1,2-didehydrocrotalane-11,15-dione (7S,8R,9S)-9-hydroxy-7,8,9-trimethyl-2,3,4,4a,8,9,12,12b-octahydro-6H-5,11-dioxa-2a-azacycloundeca[cd]pentalene-6,10(7H)-dione 1,2-Didehydroretusine
Wiley ID 1310604