| SpectraBase Spectrum ID |
81v1xVWCXMl |
| Name |
ERGOSTA-5,7,22-TRIEN-3-YL ACETATE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
438.349780719 u |
| Formula |
C30H46O2 |
| InChI |
InChI=1S/C30H46O2/c1-19(2)20(3)8-9-21(4)26-12-13-27-25-11-10-23-18-24(32-22(5)31)14-16-29(23,6)28(25)15-17-30(26,27)7/h8-11,19-21,24,26-28H,12-18H2,1-7H3/b9-8+/t20-,21+,24?,26+,27?,28?,29-,30+/m0/s1 |
| InChIKey |
NGEVNHYPVVOXPB-RZGRTEBJSA-N |
| Molecular Weight |
438.696 g/mol |
| Nominal Mass |
438 u |
| Number of Peaks |
121 |
| SMILES |
C(C)(=O)OC1CC[C@@]2(C3CC[C@@]4([C@](CCC4C3=CC=C2C1)([C@@](\C=C\[C@](C)(C(C)C)[H])(C)[H])[H])C)C |
| SPLASH |
splash10-004i-5927000000-275f156f907f8e129ef6 |
| Source File Reference |
LMCM-23012-922R |
| Source of Spectrum |
Prof. J. Seibl; ETH Zurich, Switzerland |
| Synonyms |
(2R,14R,15R)-14-[(2R,3E,5R)-5,6-dimethylhept-3-en-2-yl]-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadeca-7,9-dien-5-yl acetate |
| Wiley ID |
8_18694 |
