(Q105188997)

English

[(1R,2S,4S,5R,7E,9S,11E,14R,15R)-5,14-diacetyloxy-4,8,12-trimethyl-16-methylidene-17-oxo-3,18-dioxatricyclo[13.3.0.02,4]octadeca-7,11-dien-9-yl] acetate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(5,14-Diacetyloxy-4,8,12-trimethyl-16-methylidene-17-oxo-3,18-dioxatricyclo[13.3.0.02,4]octadeca-7,11-dien-9-yl) acetate

1 reference

based on heuristic

inferred from SMILES

mass

490.220282668 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₆H₃₄O₉

0 references

canonical SMILES

O=C1OC2C3OC3(C)C(OC(=O)C)CC=C(C)C(OC(=O)C)CC=C(C)CC(OC(=O)C)C2C1=C

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isomeric SMILES

C=C1C(=O)O[C@H]2[C@@H]3O[C@@]3(C)[C@H](OC(C)=O)C/C=C(\C)[C@@H](OC(C)=O)C/C=C(\C)C[C@@H](OC(C)=O)[C@@H]12

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found in taxon

Sarcophyton crassocaule

1 reference

stated in

Cytotoxic cembrenolides and steroids from the formosan soft coral Sarcophyton crassocaule.

Identifiers

InChI

InChI=1S/C26H34O9/c1-13-8-10-19(31-16(4)27)14(2)9-11-21(33-18(6)29)26(7)24(35-26)23-22(15(3)25(30)34-23)20(12-13)32-17(5)28/h8-9,19-24H,3,10-12H2,1-2,4-7H3/b13-8+,14-9+/t19-,20+,21+,22+,23+,24-,26-/m0/s1

0 references

InChIKey

OBGWQFODBKAPHA-KZIGAWSFSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OBGWQFODBKAPHA-KZIGAWSFSA-N

1 reference

(Q105188997)

[(1R,2S,4S,5R,7E,9S,11E,14R,15R)-5,14-diacetyloxy-4,8,12-trimethyl-16-methylidene-17-oxo-3,18-dioxatricyclo[13.3.0.02,4]octadeca-7,11-dien-9-yl] acetate

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Identifiers

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