| SpectraBase Spectrum ID |
X2415zjNOo |
| Name |
[1a,2,5,5a,6,9,10,10a)-Octahydro-5,5a,6-trihydroxy-4-(hydroxymethyl)-1,7,9-trimethyl-11-oxo-1H-2,8a-methanocyclopenta[a]cyclopropa[e]cyclodecen-1-yl]-methyl Deca-2,4,6-trienoate |
| Alternate Name(s) |
17-[deca-2,4,6-trienoyloxy]-ingenol
[4,5,6-trihydroxy-7-(hydroxymethyl)-3,11,14-trimethyl-15-oxotetracyclo[7.5.1.0(1,5).0(10,12)]pentadeca-2,7-dien-11-yl]methyl (2E,4E,6E)-2,4,6-decatrienoate
[Octahydro-5,5a,6-trihydroxy-4-(hydroxymethyl)-1,7,9-trimethyl-11-oxo-1H-2,8a-methanocyclopenta[a]cyclopropa[e]cyclodecen-1-yl]-methyl Deca-2,4,6-trienoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H40O7 |
| InChI |
InChI=1S/C30H40O7/c1-5-6-7-8-9-10-11-12-23(32)37-17-28(4)22-13-19(3)29-15-18(2)25(33)30(29,36)26(34)20(16-31)14-21(24(22)28)27(29)35/h7-12,14-15,19,21-22,24-26,31,33-34,36H,5-6,13,16-17H2,1-4H3/b8-7+,10-9+,12-11+ |
| InChIKey |
ZHXKANCSLQCPNW-SNUJAXHWSA-N |
| Molecular Weight |
512.643 g/mol |
| SMILES |
OCC1=CC2C(C3(C(C1O)(C(C(=C3)C)O)O)C(CC1C2C1(COC(\C=C\C=C\C=C\CCC)=O)C)C)=O |
| SPLASH |
splash10-001i-6902000000-79ab7427c9bc4d276a96 |
| Source of Spectrum |
C-88-3149-1 |
| Wiley ID |
1590587 |
![[1a,2,5,5a,6,9,10,10a)-Octahydro-5,5a,6-trihydroxy-4-(hydroxymethyl)-1,7,9-trimethyl-11-oxo-1H-2,8a-methanocyclopenta[a]cyclopropa[e]cyclodecen-1-yl]-methyl Deca-2,4,6-trienoate](/api/spectrum/X2415zjNOo/structure.png?h=300&w=458 "[1a,2,5,5a,6,9,10,10a)-Octahydro-5,5a,6-trihydroxy-4-(hydroxymethyl)-1,7,9-trimethyl-11-oxo-1H-2,8a-methanocyclopenta[a]cyclopropa[e]cyclodecen-1-yl]-methyl Deca-2,4,6-trienoate")
