(Q104401803)

English

(1R,4R,9S,10R,14R)-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-3,14-diol

group of stereoisomers with the chemical formula C₂₀H₃₄O₃

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Statements

instance of

group of stereoisomers

0 references

1 reference

322.250794948 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₀H₃₄O₃

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canonical SMILES

OCC1(O)CC23CC(O)C4C(C)(C)CCCC4(C)C3CCC1C2

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isomeric SMILES

CC1(C)CCC[C@]2(C)[C@@H]1C(O)C[C@@]13CC(CC[C@@H]21)[C@@](O)(CO)C3

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found in taxon

Calibrachoa parviflora

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stated in

Diterpenes of Calibrachoa parviflora

Identifiers

InChI

InChI=1S/C20H34O3/c1-17(2)7-4-8-18(3)15-6-5-13-9-19(15,10-14(22)16(17)18)11-20(13,23)12-21/h13-16,21-23H,4-12H2,1-3H3/t13?,14?,15-,16+,18-,19+,20-/m0/s1

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InChIKey

NRRPVTKXJHEKLP-RJYAXXMKSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

NRRPVTKXJHEKLP-RJYAXXMKSA-N

1 reference

(Q104401803)

(1R,4R,9S,10R,14R)-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-3,14-diol

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Identifiers

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