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aphidicolan-16beta-ol
MNXM3539 is deprecated and here replaced by MNXM1364482
!!! Alternative mappings exist !!!
| Properties | Image |
| MNX_ID | MNXM1364482 |
 |
| reference | chebi:29519 |
| formula | C20H34O |
| global charge | 0 |
| mol weight | 290.491 |
| InChIKey | ODCPNBCPLWJVQI-AEVHBADWSA-N |
| InChI | InChI=1S/C20H34O/c1-17(2)8-5-9-18(3)16(17)7-6-14-12-15-13-20(14,18)11-10-19(15,4)21/h14-16,21H,5-13H2,1-4H3/t14-,15+,16-,18-,19+,20-/m0/s1 |
| SMILES | CC1(C)CCC[C@@]2(C)[C@H]1CC[C@H]1C[C@@H]3C[C@@]12CC[C@@]3(C)O |
MNX internals
| InChI (mnx) | InChI=1/C20H34O/c1-17(2)8-5-9-18(3)16(17)7-6-14-12-15-13-20(14,18)11-10-19(15,4)21/h14-16,21H,5-13H2,1-4H3/t14-,15+,16-,18-,19+,20-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:17]1([CH3:2])[CH2:8][CH2:5][CH2:9][C@@:18]2([CH3:3])[C@H:16]1[CH2:7][CH2:6][C@H:14]1[CH2:12][C@@H:15]3[CH2:13][C@@:20]12[CH2:11][CH2:10][C@@:19]3([CH3:4])[OH:21] |
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| Parent-child relations graph |
| Occurences in reactions | #reac |
| in my sandbox |
0 |
| in MNXref (generic) | 3 |
| in models (compartimentalized) |
0 |
|
Similar chemical compounds in external resources
| Identifier | Description |
CHEBI:29519 chebi:29519 ODCPNBCPLWJVQI-AEVHBADWSA-N
| aphidicolan-16beta-ol (4aS,6aS,8R,9R,11aS,11bS)-4,4,9,11b-tetramethyltetradecahydro-8,11a-methanocyclohepta[a]naphthalen-9-ol Aphidicolan-16beta-ol
|
kegg.compound:C11890 keggC:C11890 ODCPNBCPLWJVQI-AEVHBADWSA-N
| Aphidicolan-16beta-ol
|
metacyc.compound:CPD-11425 metacycM:CPD-11425 ODCPNBCPLWJVQI-AEVHBADWSA-N
| aphidicolan-16beta-ol (4aS,6aS,8S,9R,11aS,11bS)-4,4,9,11b-tetramethyltetradecahydro-8,11a-methanocyclohepta[a]naphthalen-9-ol
|
keggC:M_C11890
| secondary/obsolete/fantasy identifier
|