Heliocide H2 (CHEBI:176028)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Heliocide H2

ChEBI ID	CHEBI:176028

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C25H30O5

Net Charge

Average Mass

410.510

Monoisotopic Mass

410.20932

InChI

InChI=1S/C25H30O5/c1-13(2)7-6-8-15-9-10-25(5)17(11-15)22(28)19-16(12-26)21(27)23(29)18(14(3)4)20(19)24(25)30/h7,9,12,14,17,27,29H,6,8,10-11H2,1-5H3

InChIKey

BSQZWSGAKJSBOZ-UHFFFAOYSA-N

SMILES

O=C1C2(C(CC(=CC2)CCC=C(C)C)C(=O)C=3C1=C(C(C)C)C(O)=C(O)C3C=O)C

ChEBI Ontology
Outgoing	Heliocide H2 (CHEBI:176028) is a hydroxyanthraquinones (CHEBI:37485)

IUPAC Name

2,3-dihydroxy-10a-methyl-7-(4-methylpent-3-enyl)-9,10-dioxo-4-propan-2-yl-8,8a-dihydro-5H-anthracene-1-carbaldehyde