| SpectraBase Spectrum ID |
5l1FHtGGyQL |
| Name |
4H-1,4:8,10a-Dimethanoazuleno[1,2-d]oxepin, gibb-4-ene-1,10-dicarboxylic acid deriv. |
| Alternate Name(s) |
Gibb-4-ene-1,10-dicarboxylic acid, 3-ethyl-2,3,7-trihydroxy-1-methyl-8-methylene-, .gamma.-lactone, methyl ester, (1.alpha.,2.beta.,3.alpha.,4b.beta.,10.beta.)-
ent-2.alpha.-ethyl-3.alpha.,2.beta.,13-trihydroxy-20-norgibberella-1(10),16-diene-7,19-dioic acid 7-methyl ester 19,2-lactone
Methyl (1S,2S,7S,13S,17S)-7-ethyl-13,17-dihydroxy-4-methyl-14-methylene-5-oxo-6-oxapentacyclo[11.2.1.1(4,7).0(1,10).0(3,9)]heptadec-8-ene-2-carboxylate |
| CAS Registry Number |
121709-39-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28O6 |
| InChI |
InChI=1S/C22H28O6/c1-5-22-9-12-13-6-7-21(26)10-20(13,8-11(21)2)15(16(23)27-4)14(12)19(3,17(22)24)18(25)28-22/h9,13-15,17,24,26H,2,5-8,10H2,1,3-4H3/t13?,14?,15-,17+,19?,20+,21+,22+/m1/s1 |
| InChIKey |
PMIUUOAFWNEDGF-GRBHOVLGSA-N |
| Molecular Weight |
388.460 g/mol |
| SMILES |
O[C@@]12C[C@@]3([C@](C4C(=C[C@]5([C@](C4(C(O5)=O)C)(O)[H])CC)C3CC2)(C(=O)OC)[H])CC1=C |
| SPLASH |
splash10-01di-3079000000-4552f50cd742b0c40337 |
| Source of Spectrum |
KC-1988-1991-59 |
| Wiley ID |
1363878 |
![4H-1,4:8,10a-Dimethanoazuleno[1,2-d]oxepin, gibb-4-ene-1,10-dicarboxylic acid deriv.](/api/spectrum/5l1FHtGGyQL/structure.png?h=300&w=458 "4H-1,4:8,10a-Dimethanoazuleno[1,2-d]oxepin, gibb-4-ene-1,10-dicarboxylic acid deriv.")
