| SpectraBase Spectrum ID |
EC2ri1tQcAY |
| Name |
(3aS,9aR)-8-[2-[(3aS,9aR)-2,2-dimethyl-5-oxidanyl-3a,4,9,9a-tetrahydrobenzo[f][1,3]benzodioxol-8-yl]ethynyl]-2,2-dimethyl-3a,4,9,9a-tetrahydrobenzo[f][1,3]benzodioxol-5-ol |
| Alternate Name(s) |
(3aS,9aR)-8-[2-[(3aS,9aR)-5-hydroxy-2,2-dimethyl-3a,4,9,9a-tetrahydrobenzo[f][1,3]benzodioxol-8-yl]ethynyl]-2,2-dimethyl-3a,4,9,9a-tetrahydrobenzo[f][1,3]benzodioxol-5-ol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H30O6 |
| InChI |
InChI=1S/C28H30O6/c1-27(2)31-23-11-17-15(7-9-21(29)19(17)13-25(23)33-27)5-6-16-8-10-22(30)20-14-26-24(12-18(16)20)32-28(3,4)34-26/h7-10,23-26,29-30H,11-14H2,1-4H3/t23-,24-,25+,26+/m1/s1 |
| InChIKey |
UKVOXPIKXFZCRZ-XPGKHFPBSA-N |
| Molecular Weight |
462.542 g/mol |
| SMILES |
Oc1c2c(c(C#Cc3ccc(c4c3C[C@]3(OC(O[C@]3(C4)[H])(C)C)[H])O)cc1)C[C@]1(OC(O[C@]1(C2)[H])(C)C)[H] |
| SPLASH |
splash10-0006-0900000000-166cbac29414053e2ac4 |
| Source of Spectrum |
J-66-7136-19 |
| Wiley ID |
1536103 |
![(3aS,9aR)-8-[2-[(3aS,9aR)-2,2-dimethyl-5-oxidanyl-3a,4,9,9a-tetrahydrobenzo[f][1,3]benzodioxol-8-yl]ethynyl]-2,2-dimethyl-3a,4,9,9a-tetrahydrobenzo[f][1,3]benzodioxol-5-ol](/api/spectrum/EC2ri1tQcAY/structure.png?h=300&w=458 "(3aS,9aR)-8-[2-[(3aS,9aR)-2,2-dimethyl-5-oxidanyl-3a,4,9,9a-tetrahydrobenzo[f][1,3]benzodioxol-8-yl]ethynyl]-2,2-dimethyl-3a,4,9,9a-tetrahydrobenzo[f][1,3]benzodioxol-5-ol")
