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17,22-SECO-3-OXO-22,23-DIHYDROXY-DELTA(12,16)-OLEANONIC-ACID
SpectraBase Compound ID 25RA0rQr1Ho
InChI InChI=1S/C30H46O5/c1-26(2,15-16-31)17-20-19(25(34)35)9-13-29(5)21(20)7-8-23-27(3)12-11-24(33)28(4,18-32)22(27)10-14-30(23,29)6/h7,9,20,22-23,31-32H,8,10-18H2,1-6H3,(H,34,35)/t20-,22+,23+,27-,28-,29+,30+/m0/s1
InChIKey SYZVSPCVZZJWEF-QOXHTCMMSA-N
Mol Weight 486.7 g/mol
Molecular Formula C30H46O5
Exact Mass 486.334525 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FS9QT9XVB3l
Name 17,22-SECO-3-OXO-22,23-DIHYDROXY-DELTA(12,16)-OLEANONIC-ACID
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H46O5
InChI InChI=1S/C30H46O5/c1-26(2,15-16-31)17-20-19(25(34)35)9-13-29(5)21(20)7-8-23-27(3)12-11-24(33)28(4,18-32)22(27)10-14-30(23,29)6/h7,9,20,22-23,31-32H,8,10-18H2,1-6H3,(H,34,35)/t20-,22+,23+,27-,28-,29+,30+/m0/s1
InChIKey SYZVSPCVZZJWEF-QOXHTCMMSA-N
Literature Reference Author M.D.GRECA,A.FIORENTINO,P.MONACO,L.PREVITERA
Literature Reference Citation PHYTOCHEM.,35,201(1994)
Literature Reference DOI 10.1016/s0031-9422(00)90534-x
Molecular Weight 486.692 g/mol
Solvent C5D5N
Source File Reference UWLU24143