| SpectraBase Spectrum ID |
KMXMvje340v |
| Name |
2H,6H-1,4,5-trioxadicyclopent(a,hi)inden-2-one, 3-ethylidene-3,3a,4a,7,7a,9b-hexahydro-6-hydroxy-, (3E,3aalpha,4abeta,6beta,7abeta,9aR*,9bbeta)-(+)- |
| Alternate Name(s) |
Allamcin
2H,6H-1,4,5-trioxadicyclopenta(a,hi)inden-2-one, 3-ethylidene-3,3a,4a,7,7a,9b-hexahydro-6-hydroxy-, (3E,3aalpha,4abeta,6beta,7abeta,9aR*,9bbeta)-(+)- |
| CAS Registry Number |
86971-79-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H14O5 |
| InChI |
InChI=1S/C13H14O5/c1-2-7-10-13(18-11(7)15)4-3-6-5-8(14)16-12(17-10)9(6)13/h2-4,6,8-10,12,14H,5H2,1H3/b7-2+/t6-,8+,9-,10?,12+,13+/m1/s1 |
| InChIKey |
DWWKELQVGKIHDR-LGRXBCACSA-N |
| Molecular Weight |
250.250 g/mol |
| SMILES |
O[C@@]1(C[C@@]2([C@]3([C@]4(C(\C(=C/C)C(O4)=O)O[C@@]3(O1)[H])C=C2)[H])[H])[H] |
| SPLASH |
splash10-0k92-9700000000-a7f50f7bddc3a85320a9 |
| Source of Spectrum |
KC-1988-1133-3 |
| Wiley ID |
1253097 |
