(Q105276722)

English

(1R,2S,4S,6S,10E,13S,14R)-2,11-dimethyl-7-methylidene-14-prop-1-en-2-yl-5,16-dioxatricyclo[11.2.1.04,6]hexadec-10-en-2-ol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

cembrane

0 references

mass

318.21949482 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,2S,4S,6S,13S,14R)-2,11-dimethyl-7-methylidene-14-prop-1-en-2-yl-5,16-dioxatricyclo[11.2.1.04,6]hexadec-10-en-2-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₀O₃

0 references

canonical SMILES

OC1(C)CC2OC2C(=C)CCC=C(C)CC3OC1CC3C(=C)C

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isomeric SMILES

C=C1CC/C=C(\C)C[C@@H]2O[C@H](C[C@@H]2C(=C)C)[C@@](C)(O)C[C@@H]2O[C@@H]12

0 references

found in taxon

Lobophytum crassum

1 reference

stated in

Tetrahydrofuran cembranoids from the cultured soft coral Lobophytum crassum

Identifiers

InChI

InChI=1S/C20H30O3/c1-12(2)15-10-18-20(5,21)11-17-19(23-17)14(4)8-6-7-13(3)9-16(15)22-18/h7,15-19,21H,1,4,6,8-11H2,2-3,5H3/b13-7+/t15-,16+,17+,18-,19+,20+/m1/s1

0 references

InChIKey

UPCYZPSCAGJZML-HENPQHJOSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

UPCYZPSCAGJZML-HENPQHJOSA-N

(Q105276722)

(1R,2S,4S,6S,10E,13S,14R)-2,11-dimethyl-7-methylidene-14-prop-1-en-2-yl-5,16-dioxatricyclo[11.2.1.04,6]hexadec-10-en-2-ol

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Identifiers

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