Concept information
Preferred term
آرپتین A
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C31H46O12
has_role
inchi
- InChI=1S/C31H46O12/c1-8-15(2)27(36)43-26-24(41-19(6)34)23(35)25-29(7,21-12-20-9-10-37-28(20)42-21)16(3)11-22(40-18(5)33)30(25,13-38-17(4)32)31(26)14-39-31/h15-16,20-26,28,35H,8-14H2,1-7H3/t15?,16-,20-,21+,22+,23-,24-,25-,26+,28+,29-,30-,31-/m1/s1
inchikey
- MMLPTCVXPCYZCP-HHERFIPJSA-N
mass
- 610.697
monoisotopicmass
- 610.29893
smiles
- [H][C@]12CCO[C@@]1([H])O[C@@]([H])(C2)[C@@]1(C)[C@H](C)C[C@H](OC(C)=O)[C@]2(COC(C)=O)[C@]1([H])[C@H](O)[C@@H](OC(C)=O)[C@H](OC(=O)C(C)CC)[C@]21CO1
subset
- 3_STAR
synonym EXACT
- (1R,2S,3R,4S,4aR,5S,6R,8S,8aR)-3,8-bis(acetyloxy)-8a-[(acetyloxy)methyl]-5-[(2S,3aR,6aS)-hexahydrofuro[2,3-b]furan-2-yl]-4-hydroxy-5,6-dimethyloctahydro-2H-spiro[naphthalene-1,2'-oxiran]-2-yl 2-methylbutanoate
synonym RELATED
- (11S,13R,16S)-2alpha,6alpha,19-triacetoxy-3beta-(2-methylbutyryloxy)-4alpha, 18:11, 16:15, 16-triepoxy-neo-clerodan-1beta-ol
In other languages
-
English
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:197378
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