SpectraBase Spectrum ID |
B07GpyhrJo4 |
Name |
19-(ACETYL{2-[(METHYLSULFANYL)METHOXY]ETHYL}AMINO)-5-HYDROXYANDROSTAN-17-YL ACETATE |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
495.301844722 u |
Formula |
C27H45NO5S |
InChI |
InChI=1S/C27H45NO5S/c1-19(29)28(15-16-32-18-34-4)17-26-11-5-6-12-27(26,31)14-9-21-22-7-8-24(33-20(2)30)25(22,3)13-10-23(21)26/h21-24,31H,5-18H2,1-4H3 |
InChIKey |
XFYLVHIWJVDPOI-UHFFFAOYSA-N |
Molecular Weight |
495.719 g/mol |
Nominal Mass |
495 u |
Number of Peaks |
202 |
SMILES |
OC12CCCCC1(C1CCC3(C(CCC3C1CC2)OC(=O)C)C)CN(CCOCSC)C(=O)C |
SPLASH |
splash10-03di-9500000000-56d1649578e43be9f910 |
Source File Reference |
LMCM-66582-643Q |
Source of Spectrum |
Prof. J. Seibl; ETH Zurich, Switzerland |
Synonyms |
7-hydroxy-15-methyl-2-[(N-{2-[(methylsulfanyl)methoxy]ethyl}acetamido)methyl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-14-yl acetate
ACETIC ACID 10-{[ACETYL-(2-METHYLSULFANYLMETHOXY-ETHYL)-AMINO]-METHYL}-5-HYDROXY-13-METHYL-HEXADECAHYDRO-CYCLOPENTA[A]PHENANTHREN-17-YL ESTER |
Wiley ID |
8_13940 |