| SpectraBase Compound ID | 8WOZ54N9lnZ |
|---|---|
| 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-KIIHVYTKSA-N |
| Mol Weight | 426.7 g/mol |
| Molecular Formula | C30H50O |
| Exact Mass | 426.386166 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IcnaXvnli |
|---|---|
| Name | Lup-20(29)-en-3-ol, (3.beta.)- |
| CAS Registry Number | 545-47-1 |
| 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-KIIHVYTKSA-N |
| Molecular Weight | 426.729 g/mol |
| SMILES | O[C@@]1(C(C2CC[C@]3([C@]4(C(C5[C@](C(=C)C)(CC[C@@]5(CC4)C)[H])CCC3[C@]2(CC1)C)C)C)(C)C)[H] |
| SPLASH | splash10-0570-4951200000-f064addb7b9c9c263e86 |
| Source of Spectrum | CD-472-0-0 |
| Synonyms | Lup-20(29)-en-3-ol (1R,3aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-1-isopropenyl-3a,5a,5b,8,8,11a-hexamethyl-eicosahydro-cyclopenta[a]chrysen-9-ol (3-BETA)-LUP-20(29)-EN-3-OL .beta.-Viscol 1-isopropenyl-3a,5a,5b,8,8,11a-hexamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol 1H-Cyclopenta[a]chrysene, lup-20(29)-en-3-ol deriv. 3a,5a,5b,8,8,11a-hexamethyl-1-(1-methylethenyl)-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol 3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol Clerodol Fagarasterol Fagarsterol LUP-20(29)-EN-3-OL, (3-BETA)- Lup-20(29)-en-3.beta.-ol Lupenol Lupeol Monogynol B Triterpene lupeol (1R,3aR,5aR,5bR,9S,11aR)-3a,5a,5b,8,8,11a-hexamethyl-1-(1-methylethenyl)-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol (1R,3aR,5aR,5bR,9S,11aR)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol EINECS 208-889-9 NSC 90487 |
| Wiley ID | 1380178 |