(Q104918990)

English

(1S,2S,3R,4R,8R,9S,12S)-12-hydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4,8-tricarboxylic acid

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

12-Hydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4,8-tricarboxylic acid

1 reference

based on heuristic

inferred from SMILES

mass

378.167853172 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₆O₇

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canonical SMILES

O=C(O)C1C2C(C(=O)O)(C)CCCC2(C(=O)O)C3CCC4(O)C(=C)CC13C4

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isomeric SMILES

C=C1C[C@]23C[C@@]1(O)CC[C@@H]2[C@]1(C(=O)O)CCC[C@@](C)(C(=O)O)[C@H]1[C@@H]3C(=O)O

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found in taxon

radish

1 reference

stated in

Endogenous gibberellins in mature seed of Raphanus sativus L. cv. Taibyo-sobutori.

Raphanus raphanistrum

1 reference

stated in

Endogenous gibberellins in mature seed of Raphanus sativus L. cv. Taibyo-sobutori.

Identifiers

InChI

InChI=1S/C20H26O7/c1-10-8-18-9-19(10,27)7-4-11(18)20(16(25)26)6-3-5-17(2,15(23)24)13(20)12(18)14(21)22/h11-13,27H,1,3-9H2,2H3,(H,21,22)(H,23,24)(H,25,26)/t11-,12+,13+,17+,18-,19-,20+/m0/s1

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InChIKey

AUKMHZZVLPQAOX-MBQNEWINSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

AUKMHZZVLPQAOX-MBQNEWINSA-N

(Q104918990)

(1S,2S,3R,4R,8R,9S,12S)-12-hydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4,8-tricarboxylic acid

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Identifiers

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