Concept information
...
organic cyclic compound
organic heterocyclic compound
organic heteropolycyclic compound
trichothecene
Preferred term
roridoxin c
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C30H38O12
inchi
- InChI=1S/C30H38O12/c1-16-11-20-27(13-18(16)39-17(2)31)14-36-24(33)23-28(42-23)9-10-37-30(35-4,25(28)34)8-6-5-7-22(32)41-19-12-21(40-20)29(15-38-29)26(19,27)3/h5,7,11,18-21,23,25,34H,6,8-10,12-15H2,1-4H3/b7-5-/t18-,19+,20+,21+,23+,25+,26+,27+,28-,29-,30-/m0/s1
inchikey
- NIIUXENZLDFNHW-NJRWAKRPSA-N
mass
- 590.622
monoisotopicmass
- 590.23633
smiles
- O=C1O[C@H]2[C@@]3([C@@]4([C@@H](C=C(C)[C@H](C4)OC(=O)C)O[C@H](C2)[C@]35OC5)COC(=O)[C@@H]6[C@@]7([C@H]([C@](CCC=C1)(OCC7)OC)O)O6)C
subset
- 2_STAR
synonym EXACT
- [(1R,3S,7R,9S,12R,14R,15S,16S,17R,20Z,24S,28R)-28-hydroxy-24-methoxy-10,16-dimethyl-4,19-dioxospiro[2,5,13,18,25-pentaoxahexacyclo[22.3.1.114,17.01,3.07,12.07,16]nonacosa-10,20-diene-15,2'-oxirane]-9-yl] acetate
In other languages
-
Persian
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:207072
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