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Compounds

COMPOUND NPA005409

STRUCTURE
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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 -
ORIGINAL ISOLATION TAXONOMY
RANK NAME DB LINK NCBI
Domain Eukarya - 2759
Kingdom Fungi MycoBank 4751
Phylum Ascomycota MycoBank 4890
Class Sordariomycetes MycoBank 147550
Order Diaporthales MycoBank 5114
Family Gnomoniaceae MycoBank 218102
Genus Sirococcus MycoBank 83884
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