| SpectraBase Spectrum ID |
JkyCocD9fEm |
| Name |
(1S,1'S,2S,2'S,5R,5'R)-2,2'-{5,5'-[Butane-1,4-diylidebe]bis-[(2R,5Z)-tetrahydropyran-2-yl]}bis[5-(1-methylethenyl)cyclopenranol] (testudinariol A) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H46O4 |
| InChI |
InChI=1S/C30H46O4/c1-19(2)23-11-13-25(29(23)31)27-15-9-21(17-33-27)7-5-6-8-22-10-16-28(34-18-22)26-14-12-24(20(3)4)30(26)32/h7-8,23-32H,1,3,5-6,9-18H2,2,4H3/b21-7-,22-8-/t23-,24-,25-,26-,27-,28-,29+,30+/m1/s1 |
| InChIKey |
NNOHVKGJYYECPT-CUYUBAARSA-N |
| Molecular Weight |
470.694 g/mol |
| SMILES |
O[C@@]1([C@@]([C@]2(CC\C(=C\CC\C=C\3CC[C@]([C@@]4([C@]([C@](CC4)(C(=C)C)[H])(O)[H])[H])(OC3)[H])CO2)[H])(CC[C@@]1(C(=C)C)[H])[H])[H] |
| SPLASH |
splash10-0ul0-0044900000-8c5f896ac34634b0f9a3 |
| Source of Spectrum |
K-2001-1017-1 |
| Synonyms |
(1S,2S,5R)-2-[(2R,5Z)-5-[(4Z)-4-[(6R)-6-[(1S,2S,3R)-2-hydroxy-3-(1-methylethenyl)cyclopentyl]-3-oxanylidene]butylidene]-2-oxanyl]-5-(1-methylethenyl)-1-cyclopentanol
(1S,2S,5R)-2-[(2R,5Z)-5-[(4Z)-4-[(6R)-6-[(1S,2S,3R)-2-hydroxy-3-prop-1-en-2-ylcyclopentyl]oxan-3-ylidene]butylidene]oxan-2-yl]-5-prop-1-en-2-ylcyclopentan-1-ol
(1S,2S,5R)-2-[(2R,5Z)-5-[(4Z)-4-[(6R)-6-[(1S,2S,3R)-2-oxidanyl-3-prop-1-en-2-yl-cyclopentyl]oxan-3-ylidene]butylidene]oxan-2-yl]-5-prop-1-en-2-yl-cyclopentan-1-ol |
| Wiley ID |
1578808 |
![(1S,1'S,2S,2'S,5R,5'R)-2,2'-{5,5'-[Butane-1,4-diylidebe]bis-[(2R,5Z)-tetrahydropyran-2-yl]}bis[5-(1-methylethenyl)cyclopenranol] (testudinariol A)](/api/spectrum/JkyCocD9fEm/structure.png?h=300&w=458 "(1S,1'S,2S,2'S,5R,5'R)-2,2'-{5,5'-[Butane-1,4-diylidebe]bis-[(2R,5Z)-tetrahydropyran-2-yl]}bis[5-(1-methylethenyl)cyclopenranol] (testudinariol A)")
