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CHEBI:181951 - 13-Desoxyterpendole I
| Formula | C27H35NO4 |
| Net Charge | 0 |
| Average Mass | 437.580 |
| Monoisotopic Mass | 437.25661 |
| SMILES | [H][C@@]12CC[C@]3([H])[C@](C)(CC[C@]4([H])O[C@]([H])(C(C)(C)O)[C@@H](O)[C@@]5([H])O[C@@]345)[C@@]1(C)c1nc3ccccc3c1C2 |
| InChI | InChI=1S/C27H35NO4/c1-24(2,30)22-20(29)23-27(32-23)18-10-9-14-13-16-15-7-5-6-8-17(15)28-21(16)26(14,4)25(18,3)12-11-19(27)31-22/h5-8,14,18-20,22-23,28-30H,9-13H2,1-4H3/t14-,18+,19-,20+,22-,23+,25-,26+,27-/m0/s1 |
| InChIKey | HQCFFTUWLGPTOV-AUKBYRCRSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 13-Desoxyterpendole I (CHEBI:181951) is a organic heterotricyclic compound (CHEBI:26979) |
| 13-Desoxyterpendole I (CHEBI:181951) is a organooxygen compound (CHEBI:36963) |
| IUPAC Name |
|---|
| (1S,2S,5S,7S,8R,9R,11S,12R,15S)-7-(2-hydroxypropan-2-yl)-1,2-dimethyl-6,10-dioxa-24-azaheptacyclo[13.10.0.02,12.05,11.09,11.017,25.018,23]pentacosa-17(25),18,20,22-tetraen-8-ol |