(Q105218196)

English

(1S,4R,7R,9R,10R,13S,14R)-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.01,10.04,9]hexadecane-7,14-diol

chemical compound

In more languages

Statements

type of chemical entity

0 references

(1S,4R,7R,9R,10R,14R)-14-(hydroxymethyl)-5,5,9-trimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-7,14-diol

1 reference

based on heuristic

inferred from SMILES

322.250794948 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₄O₃

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canonical SMILES

OCC1(O)CC23CCC4C(C)(C)CC(O)CC4(C)C3CCC1C2

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isomeric SMILES

CC1(C)C[C@@H](O)C[C@]2(C)[C@@H]1CC[C@@]13C[C@H](CC[C@H]12)[C@@](O)(CO)C3

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Isodon flavidus

1 reference

Diterpenoids from isodon flavidus

Identifiers

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

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QCESQQPIRWFJRU-LWZJPHJSSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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