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sporulenol
MNXM97170 is deprecated and here replaced by MNXM1112490
!!! Alternative mappings exist !!!
| Properties | Image | Occurences in reactions |
|---|
| MNX_ID | MNXM1112490 | 
|
| #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 1 |
| in models (compartimentalized) |
1 |
|
| formula | C35H58O |
| charge | 0 |
| mass | 494.44877 |
| reference | chebi:67182 |
| InChIKey | XKBZJGQFALBSTF-HVUBKZQBSA-N |
| InChI | InChI=1S/C35H58O/c1-24-10-13-26(14-11-24)25(2)12-15-30-34(7)22-17-28-32(5)20-9-19-31(3,4)27(32)16-21-33(28,6)29(34)18-23-35(30,8)36/h10,14,25,27-30,36H,9,11-13,15-23H2,1-8H3/t25-,27+,28-,29+,30-,32+,33-,34+,35-/m1/s1 |
| SMILES | CC1=CCC([C@H](C)CC[C@@H]2[C@@]3(C)CC[C@@H]4[C@@]5(C)CCCC(C)(C)[C@@H]5CC[C@@]4(C)[C@@H]3CC[C@@]2(C)O)=CC1 |
|
| Parent-child relations graph |
Deprecated MNXref IDs graph |
Similar chemical compounds in external resources
| Identifier | Description |
|---|
CHEBI:67182
chebi:67182
| sporulenol
(2R,4aS,4bR,6aS,10aS,10bR,12aS)-2,4b,7,7,10a,12a-hexamethyl-1-[(3R)-3-(4-methylcyclohexa-1,4-dien-1-yl)butyl]octadecahydrochrysen-2-ol
|
seed.compound:cpd31125
seedM:cpd31125
kegg.compound:C20475
keggC:C20475
| Sporulenol
(1R,2R,4aS,4bR,6aS,10aS,10bR,12aS)-2,4b,7,7,10a,12a-Hexamethyl-1-[(3R)-3-(4-methylcyclohexa-1,4-dien-1-yl)butyl]octadecahydrochrysen-2-ol
|
keggC:M_C20475
seedM:M_cpd31125
| secondary/obsolete/fantasy identifier
|
