(Q110127166)

English

(1s,2S,15S,16R)-8,8,22,22-tetramethyl-7,13,21,27-tetraoxaheptacyclo[14.12.0.0²,¹⁵.0³,¹².0⁶,¹¹.0¹⁷,²⁶.0²⁰,²⁵]octacosa-3,5,9,11,17(26),18,20(25),23-octaene-14,28-dione

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instance of

type of chemical entity

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subclass of

Diseselin B

1 reference

based on heuristic

inferred from InChIKey

mass

456.157288488 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1s,2S,15S,16R)-8,8,22,22-tetramethyl-7,13,21,27-tetraoxaheptacyclo[14.12.0.0²,¹⁵.0³,¹².0⁶,¹¹.0¹⁷,²⁶.0²⁰,²⁵]octacosa-3,5,9,11,17(26),18,20(25),23-octaene-14,28-dione

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₈H₂₄O₆

0 references

canonical SMILES

O=C1OC2=C3C=CC(OC3=CC=C2C4C1C5C6=CC=C7OC(C=CC7=C6OC(=O)C45)(C)C)(C)C

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isomeric SMILES

CC1(C)C=Cc2c(ccc3c2OC(=O)[C@H]2[C@@H]3[C@H]3C(=O)Oc4c5c(ccc4[C@H]32)OC(C)(C)C=C5)O1

1 reference

1 reference

Dimeric Coumarin and Phenylpropanoids fromClausena lenis

Identifiers

InChI

InChI=1S/C28H24O6/c1-27(2)11-9-13-17(33-27)7-5-15-19-21(25(29)31-23(13)15)20-16-6-8-18-14(10-12-28(3,4)34-18)24(16)32-26(30)22(19)20/h5-12,19-22H,1-4H3/t19-,20+,21+,22-/m1/s1

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InChIKey

IFLHITXYYKJDMY-CLAROIROSA-N

0 references

(Q110127166)

(1s,2S,15S,16R)-8,8,22,22-tetramethyl-7,13,21,27-tetraoxaheptacyclo[14.12.0.0²,¹⁵.0³,¹².0⁶,¹¹.0¹⁷,²⁶.0²⁰,²⁵]octacosa-3,5,9,11,17(26),18,20(25),23-octaene-14,28-dione

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