(Q105212395)

English

(1R,9S,10R,11S)-4,4,10-trimethyl-9-[(2R)-2-methylbutanoyl]-1,11-bis(3-methylbut-2-enyl)-10-(4-methylpent-3-enyl)-3-oxatricyclo[7.3.1.02,7]trideca-2(7),5-diene-8,13-dione

chemical compound

In more languages

edit

Statements

instance of

type of chemical entity

0 references

subclass of

(1R,9S,10R,11S)-4,4,10-trimethyl-9-(2-methylbutanoyl)-1,11-bis(3-methylbut-2-enyl)-10-(4-methylpent-3-enyl)-3-oxatricyclo[7.3.1.02,7]trideca-2(7),5-diene-8,13-dione

1 reference

based on heuristic

inferred from SMILES

4,4,10-Trimethyl-9-(2-methylbutanoyl)-1,11-bis(3-methylbut-2-enyl)-10-(4-methylpent-3-enyl)-3-oxatricyclo[7.3.1.02,7]trideca-2(7),5-diene-8,13-dione

1 reference

based on heuristic

inferred from SMILES

mass

548.386560144 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₆H₅₂O₄

0 references

canonical SMILES

O=C1C=2C=CC(OC2C3(C(=O)C1(C(=O)C(C)CC)C(C)(CCC=C(C)C)C(CC=C(C)C)C3)CC=C(C)C)(C)C

0 references

isomeric SMILES

CC[C@@H](C)C(=O)[C@@]12C(=O)C3=C(OC(C)(C)C=C3)[C@@](CC=C(C)C)(C[C@H](CC=C(C)C)[C@@]1(C)CCC=C(C)C)C2=O

0 references

found in taxon

Hypericum perforatum

1 reference

stated in

Prenylated Phloroglucinol Derivatives from Hypericum perforatum var. angustifolium

Identifiers

InChI

InChI=1S/C36H52O4/c1-12-26(8)29(37)36-30(38)28-18-20-33(9,10)40-31(28)35(32(36)39,21-17-25(6)7)22-27(16-15-24(4)5)34(36,11)19-13-14-23(2)3/h14-15,17-18,20,26-27H,12-13,16,19,21-22H2,1-11H3/t26-,27+,34-,35-,36+/m1/s1

0 references

InChIKey

POHAQGQGMQNIJP-OHLZGGJXSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105212395)

(1R,9S,10R,11S)-4,4,10-trimethyl-9-[(2R)-2-methylbutanoyl]-1,11-bis(3-methylbut-2-enyl)-10-(4-methylpent-3-enyl)-3-oxatricyclo[7.3.1.02,7]trideca-2(7),5-diene-8,13-dione

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)