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SNATZKEIN-F;3-BETA-HYDROXYOLEAN-12-EN-23-OXO-28-OIC-ACID-28-O-[BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-[BETA-L-ARABINOFURANOSYL-(1->3)-BETA
SpectraBase Compound ID IqAdxe0vSQD
InChI InChI=1S/C54H84O21/c1-24-40(72-44-37(63)34(60)29(58)22-67-44)36(62)39(65)45(68-24)74-43-42(73-46-38(64)35(61)30(21-55)71-46)41(70-26(3)57)25(2)69-47(43)75-48(66)54-18-16-49(4,5)20-28(54)27-10-11-32-50(6)14-13-33(59)51(7,23-56)31(50)12-15-53(32,9)52(27,8)17-19-54/h10,23-25,28-47,55,58-65H,11-22H2,1-9H3/t24-,25-,28+,29+,30+,31?,32?,33+,34-,35+,36-,37+,38-,39+,40-,41+,42+,43-,44-,45-,46+,47+,50+,51+,52-,53-,54+/m1/s1
InChIKey GIOGFSNKYHZMLD-RCOWJPPTSA-N
Mol Weight 1069.2 g/mol
Molecular Formula C54H84O21
Exact Mass 1068.55051 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LSr9QEuHTWL
Name SNATZKEIN-F;3-BETA-HYDROXYOLEAN-12-EN-23-OXO-28-OIC-ACID-28-O-[BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-[BETA-L-ARABINOFURANOSYL-(1->3)-BETA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H84O21
InChI InChI=1S/C54H84O21/c1-24-40(72-44-37(63)34(60)29(58)22-67-44)36(62)39(65)45(68-24)74-43-42(73-46-38(64)35(61)30(21-55)71-46)41(70-26(3)57)25(2)69-47(43)75-48(66)54-18-16-49(4,5)20-28(54)27-10-11-32-50(6)14-13-33(59)51(7,23-56)31(50)12-15-53(32,9)52(27,8)17-19-54/h10,23-25,28-47,55,58-65H,11-22H2,1-9H3/t24-,25-,28+,29+,30+,31?,32?,33+,34-,35+,36-,37+,38-,39+,40-,41+,42+,43-,44-,45-,46+,47+,50+,51+,52-,53-,54+/m1/s1
InChIKey GIOGFSNKYHZMLD-RCOWJPPTSA-N
Literature Reference Author H.S.M.SOLIMAN,M.H.A.ELGAMAL,A.SIMON,G.TOTH,G.HORVATH,H.DUDDE CK
Literature Reference Citation J.NAT.PROD.,62,885(1999)
Literature Reference DOI 10.1021/np9803676
Molecular Weight 1069.248 g/mol
Solvent Unknown
Source File Reference UWCP8619