Concept information
...
organic cyclic compound
organic heterocyclic compound
organic heteromonocyclic compound
oxolanes
...
organic cyclic compound
organic heterocyclic compound
organic heteromonocyclic compound
oxolanes
...
organic cyclic compound
organic heterocyclic compound
organic heteromonocyclic compound
oxolanes
...
organic polycyclic compound
organic tetracyclic compound
tetracyclic triterpenoid
tirucallane triterpenoid
...
organic polycyclic compound
organic tetracyclic compound
tetracyclic triterpenoid
tirucallane triterpenoid
Preferred term
sapinmusaponin q
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C43H70O13
has_role
- CHEBI:50427
- plant metabolite
inchi
- InChI=1S/C43H70O13/c1-21(2)17-22-18-23(37(51-8)52-22)24-11-15-43(7)26-9-10-29-40(3,4)30(13-14-41(29,5)25(26)12-16-42(24,43)6)55-39-36(34(49)32(47)28(20-45)54-39)56-38-35(50)33(48)31(46)27(19-44)53-38/h9,17,22-25,27-39,44-50H,10-16,18-20H2,1-8H3/t22-,23+,24-,25+,27-,28-,29+,30+,31-,32-,33+,34+,35-,36-,37-,38+,39+,41-,42+,43-/m1/s1
inchikey
- SPDAIFHPZCHBGZ-FZFQDVCZSA-N
mass
- 795.00810
monoisotopicmass
- 794.48164
smiles
- [H][C@]1(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@@]1([H])O[C@H]1CC[C@]2(C)[C@@]3([H])CC[C@@]4(C)[C@]([H])(CC[C@]4(C)C3=CC[C@@]2([H])C1(C)C)[C@]1([H])C[C@H](O[C@H]1OC)C=C(C)C
subset
- 3_STAR
synonym EXACT
- (3beta,13alpha,14beta,20S,21R,23S)-21-methoxy-21,23-epoxylanosta-7,24-dien-3-yl 2-O-beta-D-glucopyranosyl-beta-D-glucopyranoside
synonym RELATED
- 21alpha-methoxy-3beta,21(R),23(S)-epoxytirucall-7,24-diene-3-O-beta-D-glucopyranosyl-(1->2)-beta-D-glucopyranoside
In other languages
-
Persian
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:66169
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