| SpectraBase Compound ID | 2Alz4cQ8q3X |
|---|---|
| InChI | InChI=1S/C30H48O7S/c1-18(2)16-20(31)17-19(3)21-10-14-30(6)23-8-9-24-26(27(32)36-7)25(37-38(33,34)35)12-13-28(24,4)22(23)11-15-29(21,30)5/h16,19-21,24-26,31H,8-15,17H2,1-7H3,(H,33,34,35)/t19-,20-,21-,24?,25+,26+,28-,29-,30+/m1/s1 |
| InChIKey | CJTOMRNUZCVNGX-CUGAIFAESA-N |
| Mol Weight | 552.8 g/mol |
| Molecular Formula | C30H48O7S |
| Exact Mass | 552.312075 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AubCPge6HSb |
|---|---|
| Name | METHYL-3-BETA,23(R)-DIHYDROXY-29-NOR-LANOSTA-8,24-DIEN-28-OATE-3-SULFATE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O7S |
| InChI | InChI=1S/C30H48O7S/c1-18(2)16-20(31)17-19(3)21-10-14-30(6)23-8-9-24-26(27(32)36-7)25(37-38(33,34)35)12-13-28(24,4)22(23)11-15-29(21,30)5/h16,19-21,24-26,31H,8-15,17H2,1-7H3,(H,33,34,35)/t19-,20-,21-,24?,25+,26+,28-,29-,30+/m1/s1 |
| InChIKey | CJTOMRNUZCVNGX-CUGAIFAESA-N |
| Literature Reference Author | F.D.HORGEN,B.SAKAMOTO,P.J.SCHEUER |
| Literature Reference Citation | J.NAT.PROD.,63,210(2000) |
| Literature Reference DOI | 10.1021/np990448h |
| Molecular Weight | 552.767 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWGE6176 |