| SpectraBase Compound ID | 89rmClWPE0o |
|---|---|
| InChI | InChI=1S/C27H42O7/c1-13-12-33-27(11-18(13)28)14(2)23-21(34-27)8-17-15-7-22(31)26(32)10-20(30)19(29)9-25(26,4)16(15)5-6-24(17,23)3/h13-21,23,28-30,32H,5-12H2,1-4H3/t13?,14-,15+,16-,17-,18?,19+,20+,21-,23-,24-,25+,26+,27+/m0/s1 |
| InChIKey | JYSZQOPMKVJFGC-ZCMCAOKYSA-N |
| Mol Weight | 478.6 g/mol |
| Molecular Formula | C27H42O7 |
| Exact Mass | 478.293054 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LAj3Alyq7FA |
|---|---|
| Name | Amzurogenin C |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H42O7 |
| InChI | InChI=1S/C27H42O7/c1-13-12-33-27(11-18(13)28)14(2)23-21(34-27)8-17-15-7-22(31)26(32)10-20(30)19(29)9-25(26,4)16(15)5-6-24(17,23)3/h13-21,23,28-30,32H,5-12H2,1-4H3/t13?,14-,15+,16-,17-,18?,19+,20+,21-,23-,24-,25+,26+,27+/m0/s1 |
| InChIKey | JYSZQOPMKVJFGC-ZCMCAOKYSA-N |
| Molecular Weight | 478.626 g/mol |
| SMILES | OC1C(CO[C@@]2(O[C@]3(C[C@]4([C@@]5(CC([C@]6([C@](C[C@]([C@@](C6)(O)[H])(O)[H])([C@]5(CC[C@@]4([C@]3([C@@]2(C)[H])[H])C)[H])C)O)=O)[H])[H])[H])C1)C |
| SPLASH | splash10-0a4j-0809100000-45fdeffb4bc1a396f495 |
| Source of Spectrum | X4-25-433-0 |
| Synonyms | (2alpha,3beta,5beta)-2,3,5,24-tetrahydroxyspirostan-6-one 2.alpha.,3.beta.,5,24-Tetrahydroxy-5.beta.-spirostan-6-one |
| Wiley ID | 1586248 |