(Q105144153)

English

(1R,4aS,5R,5'S,8aR)-5'-(carboxymethyl)-1,4a,5',6-tetramethylspiro[3,4,8,8a-tetrahydro-2H-naphthalene-5,2'-oxolane]-1-carboxylic acid

chemical compound

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instance of

type of chemical entity

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subclass of

5'-(carboxymethyl)-1,4a,5',6-tetramethylspiro[3,4,8,8a-tetrahydro-2H-naphthalene-5,2'-oxolane]-1-carboxylic acid

1 reference

based on heuristic

inferred from SMILES

mass

350.20932406 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₀O₅

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canonical SMILES

O=C(O)CC1(OC2(C(=CCC3C(C(=O)O)(C)CCCC32C)C)CC1)C

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isomeric SMILES

CC1=CC[C@@H]2[C@](C)(CCC[C@@]2(C)C(=O)O)[C@@]12CC[C@@](C)(CC(=O)O)O2

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found in taxon

Grindelia hirsutula

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stated in

Diterpenoid acids from Grindelia nana

1 reference

1 reference

Diterpenoid acids from Grindelia nana

Identifiers

InChI

InChI=1S/C20H30O5/c1-13-6-7-14-18(3,16(23)24)8-5-9-19(14,4)20(13)11-10-17(2,25-20)12-15(21)22/h6,14H,5,7-12H2,1-4H3,(H,21,22)(H,23,24)/t14-,17-,18+,19-,20+/m0/s1

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InChIKey

KPFMUHQQIIEYKL-LXPIXPORSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KPFMUHQQIIEYKL-LXPIXPORSA-N

(Q105144153)

(1R,4aS,5R,5'S,8aR)-5'-(carboxymethyl)-1,4a,5',6-tetramethylspiro[3,4,8,8a-tetrahydro-2H-naphthalene-5,2'-oxolane]-1-carboxylic acid

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