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(Q77497018)
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Pteridic acid A
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
6-(9-Ethyl-4-hydroxy-3,5,8-trimethyl-1,7-dioxaspiro[5.5]undec-10-en-2-yl)hepta-2,4-dienoic acid
1 reference
based on heuristic
inferred from SMILES
mass
364.224974124
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Pteridicacid B
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(2E,4E,6S)-6-[(2S,3S,4R,5S,6S,8R,9S)-9-ethyl-4-hydroxy-3,5,8-trimethyl-1,7-dioxaspiro[5.5]undec-10-en-2-yl]hepta-2,4-dienoic acid
1 reference
based on heuristic
inferred from InChI
(2E,4E,6S)-6-[(2S,3S,4R,5S,6R,8R,9S)-9-ethyl-4-hydroxy-3,5,8-trimethyl-1,7-dioxaspiro[5.5]undec-10-en-2-yl]hepta-2,4-dienoic acid
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₃₂O₅
0 references
canonical SMILES
O=C(O)C=CC=CC(C)C1OC2(OC(C)C(C=C2)CC)C(C)C(O)C1C
0 references
isomeric SMILES
CC[C@H]1C=C[C@@]2([C@@H]([C@@H]([C@@H]([C@@H](O2)[C@@H](C)/C=C/C=C/C(=O)O)C)O)C)O[C@@H]1C
0 references
found in taxon
Streptomyces hygroscopicus
2 references
stated in
Pteridic acids A and B, novel plant growth promoters with auxin-like activity from Streptomyces hygroscopicus TP-A0451.
stated in
Pteridic acids A and B, novel plant growth promoters with auxin-like activity from Streptomyces hygroscopicus TP-A0451.
Identifiers
InChI
InChI=1S/C21H32O5/c1-6-17-11-12-21(25-16(17)5)15(4)19(24)14(3)20(26-21)13(2)9-7-8-10-18(22)23/h7-17,19-20,24H,6H2,1-5H3,(H,22,23)/b9-7+,10-8+/t13-,14-,15+,16+,17-,19+,20-,21+/m0/s1
0 references
InChIKey
QBUNWYIRJPTIPL-KJDSHMCHSA-N
2 references
stated in
PubChem
PubChem CID
11013967
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
11013967
language of work or name
English
PubChem CID
11013967
2 references
stated in
PubChem
PubChem CID
11013967
language of work or name
English
matched by identifier from
InChIKey
InChIKey
QBUNWYIRJPTIPL-KJDSHMCHSA-N
ChEBI ID
214510
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C21H32O5/c1-6-17-11-12-21(25-16(17)5)15(4)19(24)14(3)20(26-21)13(2)9-7-8-10-18(22)23/h7-17,19-20,24H,6H2,1-5H3,(H,22,23)/b9-7+,10-8+/t13-,14-,15+,16+,17-,19+,20-,21+/m0/s1
UniChem compound ID
33774528
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA010549
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QBUNWYIRJPTIPL-KJDSHMCHSA-N
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