| SpectraBase Spectrum ID |
8lxenZfxKJ8 |
| Name |
(+)-3.alpha.-(6-BOC -aminohexanoic acid ester)ilimaquinone |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C33H49NO8 |
| InChI |
InChI=1S/C33H49NO8/c1-20-15-16-32(6)21(2)24(41-27(36)12-10-9-11-17-34-30(39)42-31(3,4)5)13-14-26(32)33(20,7)19-22-28(37)23(35)18-25(40-8)29(22)38/h18,20,24,26,37H,2,9-17,19H2,1,3-8H3,(H,34,39)/t20-,24+,26+,32+,33+/m0/s1 |
| InChIKey |
ZFJLJASIPIJKKB-BHANGTLGSA-N |
| Molecular Weight |
587.754 g/mol |
| SMILES |
OC1=C(C[C@@]2([C@](CC[C@]3([C@]2(CC[C@@](OC(CCCCCNC(OC(C)(C)C)=O)=O)(C3=C)[H])[H])C)(C)[H])C)C(C(=CC1=O)OC)=O |
| SPLASH |
splash10-014r-1900000000-2a06a9482a6b4fc48558 |
| Source of Spectrum |
J-62-2827-5 |
| Synonyms |
(2R,4aS,5R,6S,8aS)-5-[(2-hydroxy-5-methoxy-3,6-dioxo-1,4-cyclohexadien-1-yl)methyl]-5,6,8a-trimethyl-1-methylenedecahydro-2-naphthalenyl 6-[(tert-butoxycarbonyl)amino]hexanoate
6-tert-Butoxycarbonylamino-hexanoic acid (2R,4aS,5R,6S,8aS)-5-(2-hydroxy-5-methoxy-3,6-dioxo-cyclohexa-1,4-dienylmethyl)-5,6,8a-trimethyl-1-methylene-decahydro-naphthalen-2-yl ester |
| Wiley ID |
1409118 |
