SpectraBase Compound ID | G8nbZvyXWhd |
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InChI | InChI=1S/C34H49NO10/c1-8-35-16-31(17-39-2)21(36)13-22(41-4)34-20-14-32(38)23(42-5)15-33(44-7,25(28(34)35)26(43-6)27(31)34)24(20)29(32)45-30(37)18-9-11-19(40-3)12-10-18/h9-12,20-29,36,38H,8,13-17H2,1-7H3/t20?,21-,22+,23+,24?,25?,26+,27?,28?,29-,31+,32+,33-,34+/m1/s1 |
InChIKey | OFXAETWIISXNGM-FXPZWTLUSA-N |
Mol Weight | 631.8 g/mol |
Molecular Formula | C34H49NO10 |
Exact Mass | 631.335647 g/mol |
SpectraBase Spectrum ID | 4yHmbLItGLW |
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Name | CRASSICAUTINE |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C34H49NO10 |
InChI | InChI=1S/C34H49NO10/c1-8-35-16-31(17-39-2)21(36)13-22(41-4)34-20-14-32(38)23(42-5)15-33(44-7,25(28(34)35)26(43-6)27(31)34)24(20)29(32)45-30(37)18-9-11-19(40-3)12-10-18/h9-12,20-29,36,38H,8,13-17H2,1-7H3/t20?,21-,22+,23+,24?,25?,26+,27?,28?,29-,31+,32+,33-,34+/m1/s1 |
InChIKey | OFXAETWIISXNGM-FXPZWTLUSA-N |
Literature Reference Author | F.P.WANG,S.W.PELLETIER |
Literature Reference Citation | J.NAT.PROD.,50,55(1987) |
Literature Reference DOI | 10.1021/np50049a009 |
Molecular Weight | 631.764 g/mol |
Solvent | CDCl3 |
Source File Reference | UWED17499 |