(Q105269205)

English

(1S,2S,6Z,10S,11R,16Z)-6,16-di(butylidene)-5,15-dioxapentacyclo[9.5.2.01,13.02,10.03,7]octadeca-3(7),12-diene-4,14-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(Z)-6,6',7,3'Alpha-Diligustilide

1 reference

1 reference

380.198759376 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(1S,2S,6Z,10S,11R,16E)-6,16-di(butylidene)-5,15-dioxapentacyclo[9.5.2.01,13.02,10.03,7]octadeca-3(7),12-diene-4,14-dione

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,2S,6E,10S,11S,16E)-6,16-di(butylidene)-5,15-dioxapentacyclo[9.5.2.01,13.02,10.03,7]octadeca-3(7),12-diene-4,14-dione

1 reference

based on heuristic

inferred from InChI

(1S,2S,6Z,10S,11S,16E)-6,16-di(butylidene)-5,15-dioxapentacyclo[9.5.2.01,13.02,10.03,7]octadeca-3(7),12-diene-4,14-dione

1 reference

1 reference

C₂₄H₂₈O₄

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canonical SMILES

O=C1OC(=CCCC)C23C1=CC(CC2)C4CCC=5C(OC(=O)C5C43)=CCCC

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isomeric SMILES

CCC/C=C1\OC(=O)C2=C1CC[C@@H]1[C@H]2[C@@]23CC[C@H]1C=C2C(=O)O/C3=C\CCC

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found in taxon

Conioselinum anthriscoides

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stated in

Dimeric progestins from rhizomes of Ligusticum chuanxiong.

Ligusticum chuanxiong

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stated in

Dimeric progestins from rhizomes of Ligusticum chuanxiong.

Ligusticum striatum

1 reference

stated in

Dimeric progestins from rhizomes of Ligusticum chuanxiong.

Oreocome striata

1 reference

stated in

Dimeric progestins from rhizomes of Ligusticum chuanxiong.

Identifiers

InChI

InChI=1S/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7-,19-8-/t14-,15-,21+,24-/m0/s1

0 references

InChIKey

UBBRXVRQZJSDAK-SYRXFRKMSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105269205)

(1S,2S,6Z,10S,11R,16Z)-6,16-di(butylidene)-5,15-dioxapentacyclo[9.5.2.01,13.02,10.03,7]octadeca-3(7),12-diene-4,14-dione

Statements

Identifiers

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