| SpectraBase Spectrum ID |
EtJRyzEy7aW |
| Name |
CAESALPIN_A;1-ALPHA,6-ALPHA-DIACETOXY-5-ALPHA-HYDROXY-15-CARBOXYMETHYL-12-OXOCASSA-7-(8),13-(14)-DIENE |
| Compound Number |
1 |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C25H34O8 |
| InChI |
InChI=1S/C25H34O8/c1-13-16-10-21(33-15(3)27)25(30)23(4,5)9-8-20(32-14(2)26)24(25,6)18(16)12-19(28)17(13)11-22(29)31-7/h10,18,20-21,30H,8-9,11-12H2,1-7H3/t18-,20-,21-,24-,25+/m0/s1 |
| InChIKey |
YTZARYJQPZLCDE-LZDJTLFVSA-N |
| Literature Reference Author |
G.MA,J.YUAN,H.WU,L.CAO,X.ZHANG,L.XU,H.WEI,L.WU,Q.ZHENG,L.LI,
L.ZHANG,J.YANG,X.XU |
| Literature Reference Citation |
J.NAT.PROD.,76,1025(2013) |
| Literature Reference DOI |
10.1021/np300918q |
| Molecular Weight |
462.540 g/mol |
| Sample ID |
42574 |
| Solvent |
CDCl3 |
