| SpectraBase Compound ID | 8QvyThp6yiU |
|---|---|
| InChI | InChI=1S/C30H50O6/c1-17(2)30(35)15-14-26(5)16-29(34,13-10-18(26)30)20-9-8-19-27(20,6)12-11-21-28(19,7)24(33)22(31)23(32)25(3,4)36-21/h17-21,23-24,32-35H,8-16H2,1-7H3 |
| InChIKey | JQBHYIOSXAWFIN-UHFFFAOYSA-N |
| Mol Weight | 506.7 g/mol |
| Molecular Formula | C30H50O6 |
| Exact Mass | 506.360739 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AonGkNmOf7R |
|---|---|
| Name | neviotine-a |
| CAS Registry Number | 100244-36-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H50O6 |
| InChI | InChI=1S/C30H50O6/c1-17(2)30(35)15-14-26(5)16-29(34,13-10-18(26)30)20-9-8-19-27(20,6)12-11-21-28(19,7)24(33)22(31)23(32)25(3,4)36-21/h17-21,23-24,32-35H,8-16H2,1-7H3 |
| InChIKey | JQBHYIOSXAWFIN-UHFFFAOYSA-N |
| Molecular Weight | 506.724 g/mol |
| SMILES | OC1(C2C(CC(C3C4(C(C5(C(OC(C(C(C5O)=O)O)(C)C)CC4)C)CC3)C)(CC2)O)(CC1)C)C(C)C |
| SPLASH | splash10-01rm-0921100000-c2ee58f148cb77b8b550 |
| Source of Spectrum | J-51-787-3 |
| Synonyms | 8-(1,5-dihydroxy-1-isopropyl-3a-methyloctahydro-1H-inden-5-yl)-1,3-dihydroxy-4,4,7a,10b-tetramethyldodecahydro-2H-indeno[5,4-b]oxepin-2-one 8-(1,5-dihydroxy-3a-methyl-1-propan-2-yl-2,3,4,6,7,7a-hexahydroinden-5-yl)-1,3-dihydroxy-4,4,7a,10b-tetramethyl-3,5a,6,7,8,9,10,10a-octahydro-1H-indeno[5,4-b]oxepin-2-one 8-[3a-methyl-1,5-bis(oxidanyl)-1-propan-2-yl-2,3,4,6,7,7a-hexahydroinden-5-yl]-4,4,7a,10b-tetramethyl-1,3-bis(oxidanyl)-3,5a,6,7,8,9,10,10a-octahydro-1H-indeno[5,4-b]oxepin-2-one |
| Wiley ID | 1399915 |