SpectraBase Spectrum ID |
HBPuFYD0exu |
Name |
ERGOSTA-5,7,22-TRIEN-3-OL |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
396.339216036 u |
Formula |
C28H44O |
InChI |
InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,18-20,22,24-26,29H,11-17H2,1-6H3/b8-7+/t19-,20+,22?,24+,25-,26-,27-,28+/m0/s1 |
InChIKey |
DNVPQKQSNYMLRS-CLTUJMCISA-N |
Molecular Weight |
396.659 g/mol |
Nominal Mass |
396 u |
Number of Peaks |
317 |
SMILES |
OC1CC[C@@]2([C@]3(CC[C@@]4([C@](CC[C@]4(C3=CC=C2C1)[H])([C@@](\C=C\[C@](C)(C(C)C)[H])(C)[H])[H])C)[H])C |
SPLASH |
splash10-0005-8936000000-2ef0a2716113aa2ffc07 |
Source File Reference |
LMCM-92231-793Y |
Source of Spectrum |
Prof. J. Seibl; ETH Zurich, Switzerland |
Synonyms |
10,13-DIMETHYL-17-(1,4,5-TRIMETHYL-HEX-2-ENYL)-2,3,4,9,10,11,12,13,14,15,16,17-DODECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN-3-OL
(1S,2R,11R,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-ol |
Wiley ID |
8_13740 |