| SpectraBase Spectrum ID |
1bFOCzt39ls |
| Name |
Hexa-acetyl-scirpusin A |
| Alternate Name(s) |
5-[.beta.-(3',4'-Diacetoxyphenyl)ethenyl]-3-acetoxy-6,7-bis[3'',4'' / 5''-diacetoxyphenyl]-6,7-dihydrobenzopyran |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C40H34O13 |
| InChI |
InChI=1S/C40H34O13/c1-21(41)47-31-12-10-28(11-13-31)40-39(30-17-32(48-22(2)42)19-33(18-30)49-23(3)43)38-29(16-34(50-24(4)44)20-37(38)53-40)9-7-27-8-14-35(51-25(5)45)36(15-27)52-26(6)46/h7-20,39-40H,1-6H3/b9-7+ |
| InChIKey |
VZRXEDMWCOCBJA-VQHVLOKHSA-N |
| Molecular Weight |
722.699 g/mol |
| SMILES |
C1(C(Oc2c1c(\C=C\c1cc(OC(=O)C)c(cc1)OC(=O)C)cc(OC(=O)C)c2)c1ccc(OC(=O)C)cc1)c1cc(OC(=O)C)cc(c1)OC(=O)C |
| SPLASH |
splash10-0006-9000000000-f6efea6ab5baf799868a |
| Source of Spectrum |
X2-50-295-4 |
| Wiley ID |
1602190 |
