(Q105286481)

English

[(1S,3R,6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-5,5,6-trimethylhept-6-en-2-yl]-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] acetate

chemical compound

In more languages

Statements

type of chemical entity

0 references

[7,7,12,16-Tetramethyl-15-(5,5,6-trimethylhept-6-en-2-yl)-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] acetate

1 reference

based on heuristic

inferred from SMILES

496.428031032 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₄H₅₆O₂

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canonical SMILES

O=C(OC1CCC23CC43CCC5(C)C(CCC5(C)C4CCC2C1(C)C)C(C)CCC(C(=C)C)(C)C)C

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isomeric SMILES

C=C(C)C(C)(C)CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](OC(C)=O)CC[C@@]45C[C@@]35CC[C@]12C

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Goniophlebium mengtzeense

1 reference

Triterpenoids from the fern Goniophlebium mengtzeense

Goniophlebium niponicum

1 reference

Fern constituents: Cycloartane triterpenoids and allied compounds from Polypodium formosanum and P. niponicum

Identifiers

InChI=1S/C34H56O2/c1-22(2)29(5,6)16-13-23(3)25-14-17-32(10)27-12-11-26-30(7,8)28(36-24(4)35)15-18-33(26)21-34(27,33)20-19-31(25,32)9/h23,25-28H,1,11-21H2,2-10H3/t23-,25-,26+,27+,28+,31-,32+,33-,34+/m1/s1

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VHLPXSBNWXUCDJ-WHSFMCTISA-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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