(Q105029016)

English

(1S,4R,5R,9S,10S,13R,14R)-5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-5,14-dicarboxylic acid

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

Ent-kauran-17,19-dioic acid

1 reference

based on heuristic

inferred from SMILES

mass

334.21440944 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(16R)-Kaura-17,18-dioic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

Kaura-17,18-dioic acid

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₀O₄

0 references

canonical SMILES

O=C(O)C1CC23CCC4C(C(=O)O)(C)CCCC4(C)C3CCC1C2

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isomeric SMILES

C[C@@]12CCC[C@@](C)(C(=O)O)[C@@H]1CC[C@@]13C[C@@H](CC[C@@H]12)[C@H](C(=O)O)C3

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found in taxon

Annona senegalensis

1 reference

stated in

Diterpenes from Annona senegalensis

Identifiers

InChI

InChI=1S/C20H30O4/c1-18-7-3-8-19(2,17(23)24)14(18)6-9-20-10-12(4-5-15(18)20)13(11-20)16(21)22/h12-15H,3-11H2,1-2H3,(H,21,22)(H,23,24)/t12-,13-,14-,15-,18-,19-,20+/m1/s1

0 references

InChIKey

HITLMPHPGUZLGI-HLLQXRNWSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HITLMPHPGUZLGI-HLLQXRNWSA-N

(Q105029016)

(1S,4R,5R,9S,10S,13R,14R)-5,9-dimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-5,14-dicarboxylic acid

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Identifiers

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