| SpectraBase Compound ID | 1YebDyjqvRC |
|---|---|
| InChI | InChI=1S/C32H50O5/c1-19(2)20-11-16-31(26(34)36-7)17-18-32(27(35)37-8)21(25(20)31)9-10-23-29(5)14-13-24(33)28(3,4)22(29)12-15-30(23,32)6/h20-25,33H,1,9-18H2,2-8H3 |
| InChIKey | CUWLUVLGDXWEJV-UHFFFAOYSA-N |
| Mol Weight | 514.7 g/mol |
| Molecular Formula | C32H50O5 |
| Exact Mass | 514.365825 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4z2kUu4AeXf |
|---|---|
| Name | Dimethyl 3-hydroxylup-20(29)-ene-27,28-dioate |
| CAS Registry Number | 2830-30-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C32H50O5 |
| InChI | InChI=1S/C32H50O5/c1-19(2)20-11-16-31(26(34)36-7)17-18-32(27(35)37-8)21(25(20)31)9-10-23-29(5)14-13-24(33)28(3,4)22(29)12-15-30(23,32)6/h20-25,33H,1,9-18H2,2-8H3 |
| InChIKey | CUWLUVLGDXWEJV-UHFFFAOYSA-N |
| Molecular Weight | 514.747 g/mol |
| SMILES | OC1CCC2(C(C1(C)C)CCC1(C2CCC2C1(CCC1(C2C(C(C)=C)CC1)C(OC)=O)C(OC)=O)C)C |
| SPLASH | splash10-0fhi-0920000000-eecc97f87baa846138b9 |
| Source of Spectrum | W5-1989-64980-556 |
| Synonyms | 9-Hydroxy-1-isopropenyl-5b,8,8,11a-tetramethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a,5a-dicarboxylic acid dimethyl ester 9-Hydroxy-5b,8,8,11a-tetramethyl-1-(1-methylethenyl)-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a,5a-dicarboxylic acid dimethyl ester Dimethyl 5b,8,8,11a-tetramethyl-9-oxidanyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a,5a-dicarboxylate Dimethyl 9-hydroxy-1-isopropenyl-5b,8,8,11a-tetramethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a,5a-dicarboxylate Dimethyl 9-hydroxy-5b,8,8,11a-tetramethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a,5a-dicarboxylate Methyl 2.alpha.-carboxymethyl-3.beta.-hydroxy-nor-A(1)-lup-20(29)-en-28-oate |
| Wiley ID | 1401207 |