(Q105168247)

English

7-Oxoabieta-8(14),9(11),12-triene-18-ol hexadecanoate

chemical compound

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No label defined

No description defined

Statements

type of chemical entity

0 references

(1,4a-dimethyl-9-oxo-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthren-1-yl)methyl hexadecanoate

1 reference

based on heuristic

inferred from SMILES

538.438595716 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₆H₅₈O₃

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canonical SMILES

O=C(OCC1(C)CCCC2(C3=CC=C(C=C3C(=O)CC21)C(C)C)C)CCCCCCCCCCCCCCC

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isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@]1(C)CCC[C@]2(C)c3ccc(C(C)C)cc3C(=O)C[C@H]21

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Juniperus brevifolia

1 reference

Diterpene constituents of leaves from Juniperus brevifolia

Identifiers

InChI=1S/C36H58O3/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-20-34(38)39-27-35(4)23-19-24-36(5)31-22-21-29(28(2)3)25-30(31)32(37)26-33(35)36/h21-22,25,28,33H,6-20,23-24,26-27H2,1-5H3/t33-,35-,36+/m0/s1

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MNBBDLGYRHAIGE-REAFWAPUSA-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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