(Q105283771)

English

(1S,4E,8E,12R,13S)-12-hydroxy-4,8,12-trimethyl-16-methylidene-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-15-one

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

12-Hydroxy-4,8,12-trimethyl-16-methylidene-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-15-one

1 reference

based on heuristic

inferred from SMILES

mass

318.21949482 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1R,12S,13R)-12-hydroxy-4,8,12-trimethyl-16-methylidene-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-15-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,4E,8E,12R,13S)-12-hydroxy-4,8,12-trimethyl-16-methylidene-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-15-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,12R,13S)-12-hydroxy-4,8,12-trimethyl-16-methylidene-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-15-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,4E,8E,12S,13R)-12-hydroxy-4,8,12-trimethyl-16-methylidene-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-15-one

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1R,8E,12S,13R)-12-hydroxy-4,8,12-trimethyl-16-methylidene-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-15-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₀O₃

0 references

canonical SMILES

O=C1OC2CC(C1=C)CCC(=CCCC(=CCCC2(O)C)C)C

0 references

isomeric SMILES

C=C1C(=O)O[C@H]2C[C@@H]1CC/C(C)=C/CC/C(C)=C/CC[C@@]2(C)O

0 references

found in taxon

Pseudoplexaura porosa

1 reference

stated in

Marine antitumor agents: 14-deoxycrassin and pseudoplexaurol, new cembranoid diterpenes from the Caribbean gorgonian Pseudoplexaura porosa

Identifiers

InChI

InChI=1S/C20H30O3/c1-14-7-5-8-15(2)10-11-17-13-18(23-19(21)16(17)3)20(4,22)12-6-9-14/h8-9,17-18,22H,3,5-7,10-13H2,1-2,4H3/b14-9+,15-8+/t17-,18-,20+/m0/s1

0 references

InChIKey

VCLOBFBJUDXQFF-ZPPTYIRSSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VCLOBFBJUDXQFF-ZPPTYIRSSA-N

1 reference

(Q105283771)

(1S,4E,8E,12R,13S)-12-hydroxy-4,8,12-trimethyl-16-methylidene-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-15-one

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Identifiers

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