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NIGA-ICHIGOSIDE-F1;2-ALPHA,3-BETA,19-ALPHA,23-TETRAHYDROXY-URS-12-EN-28-OIC-ACID-28-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID EYgYGeT0YMe
InChI InChI=1S/C36H58O11/c1-18-9-12-36(30(44)47-29-26(42)25(41)24(40)21(16-37)46-29)14-13-33(4)19(27(36)35(18,6)45)7-8-23-31(2)15-20(39)28(43)32(3,17-38)22(31)10-11-34(23,33)5/h7,18,20-29,37-43,45H,8-17H2,1-6H3/t18-,20-,21-,22?,23?,24-,25+,26-,27?,28+,29+,31+,32+,33-,34-,35-,36+/m1/s1
InChIKey WKKBYJLXSKPKSC-VBXFOCAZSA-N
Mol Weight 666.8 g/mol
Molecular Formula C36H58O11
Exact Mass 666.397913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID gWZk3IbFvo
Name NIGA-ICHIGOSIDE-F1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H58O11
InChI InChI=1S/C36H58O11/c1-18-9-12-36(30(44)47-29-26(42)25(41)24(40)21(16-37)46-29)14-13-33(4)19(27(36)35(18,6)45)7-8-23-31(2)15-20(39)28(43)32(3,17-38)22(31)10-11-34(23,33)5/h7,18,20-29,37-43,45H,8-17H2,1-6H3/t18-,20-,21-,22?,23?,24-,25+,26-,27?,28+,29+,31+,32+,33-,34-,35-,36+/m1/s1
InChIKey WKKBYJLXSKPKSC-VBXFOCAZSA-N
Literature Reference Author T.SETO,T.TANAKA,O.TANAKA,N.NARUHASHI
Literature Reference Citation PHYTOCHEM.,23,2829(1984)
Literature Reference DOI 10.1016/0031-9422(84)83023-X
Molecular Weight 666.850 g/mol
Solvent PYRIDINE
Source File Reference UWBK336