| SpectraBase Spectrum ID |
2ugXNOtZsu |
| Name |
7.beta.-hydroxy-3,11,15-trioxo-25,26,27-trisnorlanosta-8,20(21)-dien-24-oic acid |
| Appearance |
Colorless needles |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H36O6 |
| InChI |
InChI=1S/C27H36O6/c1-14(7-8-21(32)33)15-11-20(31)27(6)23-16(28)12-18-24(2,3)19(30)9-10-25(18,4)22(23)17(29)13-26(15,27)5/h15-16,18,28H,1,7-13H2,2-6H3,(H,32,33)/t15-,16+,18+,25+,26-,27+/m1/s1 |
| InChIKey |
APMICFQMLNFXRZ-LIFSRMHQSA-N |
| Instrument Name |
JEOL JMS-BU20 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np040230h |
| Molecular Weight |
456.579 g/mol |
| Optical Rotation |
[a]D25 = +69.9 (c = 0.20, CHCl3) |
| Reported Formula |
C27H36O6 |
| SMILES |
OC(CCC([C@]1(CC([C@@]2([C@@]1(CC(C1=C2[C@](C[C@]2(C(C(CC[C@]12C)=O)(C)C)[H])(O)[H])=O)C)C)=O)[H])=C)=O |
| SPLASH |
splash10-07fr-0029800000-c779aaa9596eef7d65a2 |
| Source of Spectrum |
G4-68-563-1 |
| Synonyms |
20(21)-Dehydrolucidenic acid A |
| Wiley ID |
1882007 |
