| Properties | Image |
|---|
| MNX_ID | MNXM42738 |
 |
| reference | chebi:175847 |
| formula | C30H30O7 |
| global charge | 0 |
| mol weight | 502.563 |
| InChIKey | GKWNQOINHKVKOT-UHFFFAOYSA-N |
| InChI | InChI=1S/C30H30O7/c1-13(2)7-8-14-23(33)22-24(34)16-11-17-20-21(18(31)12-19(32)28(20)37-30(17,5)6)27(16)35-26(22)15-9-10-29(3,4)36-25(14)15/h7,9-10,12,17,31-33H,8,11H2,1-6H3 |
| SMILES | CC(C)=CCC1=C(O)C2=C(OC3=C(CC4C5=C(OC4(C)C)C(O)=CC(O)=C35)C2=O)C2=C1OC(C)(C)C=C2 |
MNX internals
| InChI (mnx) | InChI=1/C30H30O7/c1-13(2)7-8-14-23(33)22-24(34)16-11-17-20-21(18(31)12-19(32)28(20)37-30(17,5)6)27(16)35-26(22)15-9-10-29(3,4)36-25(14)15/h7,9-10,12,17,31-33H,8,11H2,1-6H3/t17? |
 |
| SMILES (mnx) | [CH3:1][C:13]([CH3:2])=[CH:7][CH2:8][C:14]1=[C:23]([OH:33])[C:22]2=[C:26]([C:15]3=[C:25]1[O:36][C:29]([CH3:3])([CH3:4])[CH:10]=[CH:9]3)[O:35][C:27]1=[C:16]([CH2:11][CH:17]3[C:20]4=[C:28]([C:19]([OH:32])=[CH:12][C:18]([OH:31])=[C:21]41)[O:37][C:30]3([CH3:5])[CH3:6])[C:24]2=[O:34] |
|
| Parent-child relations graph |
| Occurences in reactions | #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 0 |
| in models (compartimentalized) |
0 |
|
Similar chemical compounds in external resources
| Identifier | Description |
|---|
CHEBI:175847
chebi:175847
GKWNQOINHKVKOT-UHFFFAOYSA-N
| Artonin F
12,21,23-trihydroxy-8,8,18,18-tetramethyl-11-(3-methylbut-2-enyl)-3,9,19-trioxahexacyclo[15.6.1.02,15.04,13.05,10.020,24]tetracosa-1(24),2(15),4,6,10,12,20,22-octaen-14-one
|
lipidmaps:LMPK12111518
lipidmapsM:LMPK12111518
GKWNQOINHKVKOT-UHFFFAOYSA-N
| Artonin F
|
hmdb:HMDB0035187
GKWNQOINHKVKOT-UHFFFAOYSA-N
| Artonin F
12,21,23-trihydroxy-8,8,18,18-tetramethyl-11-(3-methylbut-2-en-1-yl)-3,9,19-trioxahexacyclo[15.6.1.0²,¹⁵.0⁴,¹³.0⁵,¹⁰.0²⁰,²⁴]tetracosa-1(24),2(15),4(13),5(10),6,11,20,22-octaen-14-one
artonin F
|
hmdb:HMDB35187
| secondary/obsolete/fantasy identifier
|