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Compounds

COMPOUND NPA017774

STRUCTURE
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PROPERTIES
NPAID NPA017774
CLUSTER ID 2318
NODE ID 163
NAME Brassicasterol
FORMULA C28H46O
MOLECULAR WEIGHT (Da) 398.6750
ACCURATE MASS (Da) 398.3549
ORIGIN ORGANISM TYPE Fungus
ORIGIN GENUS Tuber
ORIGIN SPECIES indicum
InChIKey OILXMJHPFNGGTO-KDISEMKTSA-N
InChI InChI=1S/C28H46O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-9,18-20,22-26,29H,10-17H2,1-6H3/b8-7+/t19-,20+,22-,23?,24+,25-,26-,27-,28+/m0/s1
SMILES C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2CC=C4[C@@]3(CC[C@@H](C4)O)C)C
ORIGINAL ISOLATION REFERENCE
CITATION Harki, E; Klaebe, A; Talou, T; Dargent, R Identification and quantification of Tuber melanosporum Vitt. sterols Steroids 1996 61 (10) 609-612.
DOI 10.1016/s0039-128x(96)00121-3 PMID 8910974
ORIGINAL ISOLATION TAXONOMY
RANK NAME DB LINK NCBI
Domain Eukarya - 2759
Kingdom Fungi MycoBank 4751
Phylum Ascomycota MycoBank 4890
Class Pezizomycetes MycoBank 147549
Order Pezizales MycoBank 5185
Family Tuberaceae MycoBank 40289
Genus Tuber MycoBank 36048
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