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(Q77423959)
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Dehydrotrametenonic acid
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
6-Methyl-2-(4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl)hept-5-enoic acid
1 reference
based on heuristic
inferred from SMILES
mass
452.329045268
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Dehydrotramenoic acid
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₀H₄₄O₃
0 references
canonical SMILES
O=C(O)C(CCC=C(C)C)C1CCC2(C3=CCC4C(C(=O)CCC4(C3=CCC12C)C)(C)C)C
0 references
isomeric SMILES
CC(C)=CCCC(C(=O)O)[C@H]1CC[C@@]2(C)C3=CC[C@H]4C(C)(C)C(=O)CC[C@]4(C)C3=CC[C@]12C
0 references
found in taxon
Macrohyporia cocos
2 references
stated in
Dehydrotrametenonic acid and dehydroeburiconic acid from Poria cocos and their inhibitory effects on eukaryotic DNA polymerase alpha and beta
stated in
Triterpene Acids fromPoria cocosand Their Anti-Tumor-Promoting Effects
Wolfiporia cocos
2 references
stated in
Dehydrotrametenonic acid and dehydroeburiconic acid from Poria cocos and their inhibitory effects on eukaryotic DNA polymerase alpha and beta
stated in
Triterpene Acids fromPoria cocosand Their Anti-Tumor-Promoting Effects
Identifiers
InChI
InChI=1S/C30H44O3/c1-19(2)9-8-10-20(26(32)33)21-13-17-30(7)23-11-12-24-27(3,4)25(31)15-16-28(24,5)22(23)14-18-29(21,30)6/h9,11,14,20-21,24H,8,10,12-13,15-18H2,1-7H3,(H,32,33)/t20?,21-,24+,28-,29-,30+/m1/s1
0 references
InChIKey
PLNOCPRTFZIBRT-DBAPKEHCSA-N
2 references
stated in
PubChem
PubChem CID
44424826
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
44424826
language of work or name
English
PubChem CID
44424826
2 references
stated in
PubChem
PubChem CID
44424826
language of work or name
English
matched by identifier from
InChIKey
InChIKey
PLNOCPRTFZIBRT-DBAPKEHCSA-N
ChEBI ID
205360
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C30H44O3/c1-19(2)9-8-10-20(26(32)33)21-13-17-30(7)23-11-12-24-27(3,4)25(31)15-16-28(24,5)22(23)14-18-29(21,30)6/h9,11,14,20-21,24H,8,10,12-13,15-18H2,1-7H3,(H,32,33)/t20?,21-,24+,28-,29-,30+/m1/s1
UniChem compound ID
574492
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA008606
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PLNOCPRTFZIBRT-DBAPKEHCSA-N
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