(Q104945888)

English

(1S,9R,11S,12R)-1-benzoyl-4,4,12-trimethyl-9,11-bis(3-methylbut-2-enyl)-12-(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

1-benzoyl-4,4,12-trimethyl-9,11-bis(3-methylbut-2-en-1-yl)-12-(4-methylpent-3-en-1-yl)-3-oxatricyclo[7.3.1.0²,⁷]trideca-2(7),5-diene-8,13-dione

1 reference

based on heuristic

inferred from SMILES

mass

568.355260016 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₈H₄₈O₄

0 references

canonical SMILES

O=C(C=1C=CC=CC1)C23C(=O)C(C(=O)C=4C=CC(OC42)(C)C)(CC=C(C)C)CC(CC=C(C)C)C3(C)CCC=C(C)C

0 references

isomeric SMILES

CC(C)=CCC[C@]1(C)[C@@H](CC=C(C)C)C[C@]2(CC=C(C)C)C(=O)C3=C(OC(C)(C)C=C3)[C@@]1(C(=O)c1ccccc1)C2=O

0 references

found in taxon

Hypericum sampsonii

1 reference

stated in

Polyprenylated Phloroglucinol Derivatives from Hypericum sampsonii

Identifiers

InChI

InChI=1S/C38H48O4/c1-25(2)14-13-21-36(9)29(18-17-26(3)4)24-37(23-19-27(5)6)32(40)30-20-22-35(7,8)42-33(30)38(36,34(37)41)31(39)28-15-11-10-12-16-28/h10-12,14-17,19-20,22,29H,13,18,21,23-24H2,1-9H3/t29-,36+,37+,38-/m0/s1

0 references

InChIKey

BTVPHIYTBLEIHE-QOGJGJMQSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BTVPHIYTBLEIHE-QOGJGJMQSA-N

1 reference

(Q104945888)

(1S,9R,11S,12R)-1-benzoyl-4,4,12-trimethyl-9,11-bis(3-methylbut-2-enyl)-12-(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)