Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA005409
PROPERTIES
| NPAID | NPA005409 |
|---|---|
| CLUSTER ID | 2664 |
| NODE ID | 2068 |
| NAME | Dehydroazasirosterol |
| FORMULA | C46H59NO6 |
| MOLECULAR WEIGHT (Da) | 721.9790 |
| ACCURATE MASS (Da) | 721.4342 |
| ORIGIN ORGANISM TYPE | Fungus |
| ORIGIN GENUS | Sirococcus |
| ORIGIN SPECIES | 35B (UAMH 5401) |
| InChIKey | NALFSKQMZPEEDM-PSTLTJRPSA-N |
| InChI | InChI=1S/C46H59NO6/c1-22(2)23(3)10-11-24(4)29-13-14-30-28-20-33-46(21-26(48)16-19-45(46,9)31(28)17-18-44(29,30)8)47-38-40(51)36-34-27(12-15-32(49)35(34)42(38)53-33)41-37(39(36)50)43(6,7)25(5)52-41/h10-12,15,20,22-26,29-31,33,47-50H,13-14,16-19,21H2,1-9H3/b11-10+/t23-,24+,25?,26-,29+,30?,31?,33-,44+,45+,46-/m0/s1 |
| SMILES | CC1C(C2=C(O1)C3=C4C(=C(C=C3)O)C5=C(C(=O)C4=C2O)N[C@]67C[C@H](CC[C@@]6(C8CC[C@@]9([C@H](CCC9C8=C[C@@H]7O5)[C@H](C)/C=C/[C@H](C)C(C)C)C)C)O)(C)C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Ayer, William A.; Ma, Yu-Ting; 1992, ; dehydroazasirosterol, 'Sirosterol and; species', unusual steroidal adducts from a Sirococcus; Chemistry</i>, <i>Canadian Journal of; 70, vol.; 7, no.; pp., Sirosterol and dehydroazasirosterol, unusual steroidal adducts from a Sirococcus species Canadian Journal of Chemistry 1905 70 (7) 1905-1913. | ||
|---|---|---|---|
| DOI | 10.1139/v92-238 | PMID | - |
