(Q105157751)

English

6,11-Dihydroxy-3-methyl-3-(4-methyl-3-pentenyl)-3H,7H-pyrano[2,3-c]xanthen-7-one

group of stereoisomers with the chemical formula C₂₃H₂₂O₅

In more languages

Statements

group of stereoisomers

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2,6-dimethyloctane monoterpenoid

1 reference

2,6-dimethyloctane monoterpenoid

378.146723804 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₂₂O₅

0 references

canonical SMILES

O=C1C=2C=CC=C(O)C2OC3=C4C=CC(OC4=CC(O)=C13)(C)CCC=C(C)C

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Identifiers

InChI=1S/C23H22O5/c1-13(2)6-5-10-23(3)11-9-14-18(28-23)12-17(25)19-20(26)15-7-4-8-16(24)21(15)27-22(14)19/h4,6-9,11-12,24-25H,5,10H2,1-3H3

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LVANTWLBTIEHSX-UHFFFAOYSA-N

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CAS Registry Number

1 reference

CAS (formerly Chemical Abstracts Service)

25 January 2022

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26 December 2021

matched by identifier from

LVANTWLBTIEHSX-UHFFFAOYSA-N

mapping relation type

2 references

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI=1S/C23H22O5/c1-13(2)6-5-10-23(3)11-9-14-18(28-23)12-17(25)19-20(26)15-7-4-8-16(24)21(15)27-22(14)19/h4,6-9,11-12,24-25H,5,10H2,1-3H3

UniChem compound ID

1 reference

DSSTox substance ID

DTXSID101130988

1 reference

matched by identifier from

LVANTWLBTIEHSX-UHFFFAOYSA-N

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

LVANTWLBTIEHSX-UHFFFAOYSA-N

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