(Q115972422)

English

[(1Z,4R,7R,9R,10S,12E)-10-acetyloxy-2-benzyl-1,13-dichloro-7,9-dimethyltrideca-1,12-dien-4-yl] acetate

chemical compound

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

482.199064992 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₆H₃₆Cl₂O₄

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canonical SMILES

O=C(OC(CC(=CCl)CC=1C=CC=CC1)CCC(C)CC(C)C(OC(=O)C)CC=CCl)C

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isomeric SMILES

CC(=O)O[C@H](CC[C@@H](C)C[C@@H](C)[C@H](C/C=C/Cl)OC(C)=O)C/C(=C\Cl)Cc1ccccc1

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found in taxon

Trichodesmium thiebautii

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stated in

Isolation of Isotrichophycin C and Trichophycins G-I from a Collection of Trichodesmium thiebautii

Oscillatoria thiebautii

1 reference

stated in

Isolation of Isotrichophycin C and Trichophycins G-I from a Collection of Trichodesmium thiebautii

Identifiers

InChI

InChI=1S/C26H36Cl2O4/c1-19(15-20(2)26(11-8-14-27)32-22(4)30)12-13-25(31-21(3)29)17-24(18-28)16-23-9-6-5-7-10-23/h5-10,14,18-20,25-26H,11-13,15-17H2,1-4H3/b14-8+,24-18-/t19-,20-,25-,26+/m1/s1

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InChIKey

KZZHQROVUBIQFD-VXUDHDTCSA-N

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2 references

3 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

KZZHQROVUBIQFD-VXUDHDTCSA-N

(Q115972422)

[(1Z,4R,7R,9R,10S,12E)-10-acetyloxy-2-benzyl-1,13-dichloro-7,9-dimethyltrideca-1,12-dien-4-yl] acetate

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Identifiers

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