Concept information
Preferred term
برکلی تریون
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C26H34O7
has_role
- CHEBI:64152
- متابولیت پنی سیلیوم
inchi
- InChI=1S/C26H34O7/c1-13-22(4)12-15-23(5,26(13,20(31)33-8)19(30)25(7,32)18(22)29)10-9-14-21(2,3)16(27)11-17(28)24(14,15)6/h9,15,17,28,32H,1,10-12H2,2-8H3/t15-,17-,22-,23+,24-,25+,26+/m1/s1
inchikey
- BNDPVNXDSQOTOY-OKCDOLPESA-N
mass
- 458.54400
monoisotopicmass
- 458.23045
smiles
- COC(=O)[C@@]12C(=C)[C@@](C)(C[C@@H]3[C@]1(C)CC=C1C(C)(C)C(=O)C[C@@H](O)[C@@]31C)C(=O)[C@](C)(O)C2=O
subset
- 3_STAR
synonym EXACT
- berkeleytrione
- methyl (1R,6aS,7R,9S,11R,12aR,12bS)-1,9-dihydroxy-4,4,6a,9,11,12b-hexamethyl-13-methylidene-3,8,10-trioxo-1,3,4,6,6a,8,9,10,11,12,12a,12b-dodecahydro-7,11-methanocycloocta[a]naphthalene-7(2H)-carboxylate
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:69022
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