| SpectraBase Compound ID | aJUWmEhW9q |
|---|---|
| InChI | InChI=1S/C30H50O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h20-25,31-32H,1,8-18H2,2-7H3 |
| InChIKey | FVWJYYTZTCVBKE-UHFFFAOYSA-N |
| Mol Weight | 442.7 g/mol |
| Molecular Formula | C30H50O2 |
| Exact Mass | 442.381081 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | J68YJhgJPwh |
|---|---|
| Name | Lup-20(29)-ene-3,28-diol, (3.beta.)- |
| Alternate Name(s) | (3.beta.)-LUP-20(29)-ENE-3,28-DIOL LUP-20(29)-ENE-3,28-DIOL 1-isopropenyl-5a,5b,8,8,11a-pentamethyl-3a-methylol-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol 3a-(hydroxymethyl)-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol 3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-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-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-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 3aH-Cyclopenta[a]chrysene, lup-20(29)-ene-3,28-diol deriv. Betulin Betuline Betulinol Betulol LUP-20(29)-ENE-3,28-DIOL, (3BETA)- Lup-20(29)-ene-3.beta.,28-diol LUP-20(29)-ENE-3BETA,28-DIOL Lup-20(30)-ene-3.beta.,28-diol LUP-20(30)-ENE-3BETA,28-DIOL Trochol AI3-62999 EINECS 207-475-5 NSC 4644 |
| CAS Registry Number | 473-98-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H50O2 |
| InChI | InChI=1S/C30H50O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h20-25,31-32H,1,8-18H2,2-7H3 |
| InChIKey | FVWJYYTZTCVBKE-UHFFFAOYSA-N |
| Molecular Weight | 442.728 g/mol |
| SMILES | OCC12C(C3C(C4(C(C5(C(C(C(CC5)O)(C)C)CC4)C)CC3)C)(CC1)C)C(CC2)C(C)=C |
| SPLASH | splash10-0a4i-3930100000-279f306e29a3676ac332 |
| Source of Spectrum | X2-46-121-6 |
| Wiley ID | 1601096 |