Concept information
Preferred term
thiopleurotinic acid b
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C26H31NO8S
inchi
- InChI=1S/C26H31NO8S/c1-11-9-35-23-21-15(7-17-14(24(31)32)3-4-16-13(11)5-6-26(16,17)23)22(30)20(8-19(21)29)36-10-18(25(33)34)27-12(2)28/h8,11,13-14,16-18,23H,3-7,9-10H2,1-2H3,(H,27,28)(H,31,32)(H,33,34)/t11-,13-,14-,16+,17+,18+,23-,26-/m1/s1
inchikey
- CELGBPNSVHKPLO-XDYVMVOUSA-N
mass
- 517.590
monoisotopicmass
- 517.17704
smiles
- S(C=1C(=O)C2=C([C@H]3OC[C@@H](C)[C@@H]4[C@H]5[C@]3(CC4)[C@@H](C2)[C@H](C(=O)O)CC5)C(C1)=O)C[C@H](NC(=O)C)C(=O)O
subset
- 2_STAR
synonym EXACT
- (1R,2S,5R,6S,14S,17S,18S)-10-[(2R)-2-acetamido-2-carboxyethyl]sulanyl-17-methyl-9,12-dioxo-15-oxapentacyclo[12.6.0.01,6.02,18.08,13]icosa-8(13),10-diene-5-carboxylic acid
In other languages
-
Persian
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:208853
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