| SpectraBase Spectrum ID |
6rIbI7UM9sX |
| Name |
Lupeol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H50O |
| InChI |
InChI=1S/C30H50O/c1-19(2)20-11-14-27(5)17-18-29(7)21(25(20)27)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h20-25,31H,1,9-18H2,2-8H3/t20-,21+,22-,23+,24-,25+,27+,28-,29+,30+/m0/s1 |
| InChIKey |
MQYXUWHLBZFQQO-QGTGJCAVSA-N |
| Literature Reference DOI |
10.1002/cbic.201700572 |
| Molecular Weight |
426.729 g/mol |
| SMILES |
O[C@@]1(C([C@]2([C@](CC1)([C@@]1([C@@](CC2)([C@]2([C@](CC1)([C@@]1([C@](CC2)(C)CC[C@]1(C(C)=C)[H])[H])[H])C)C)[H])C)[H])(C)C)[H] |
| SPLASH |
splash10-0a4r-6950000000-bde1206a63bcc51dd196 |
| Source of Spectrum |
CBC-19-SM8-10 |
| Synonyms |
(1R,3aR,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-(prop-1-en-2-yl)icosahydro-1H-cyclopenta[a]chrysen-9-ol |
| Wiley ID |
1814198 |
