(Q104937038)

English

2-[[(1S,4aR,6R,8aS)-6-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methyl]-3-hydroxy-5-(hydroxymethyl)cyclohexa-2,5-diene-1,4-dione

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

3-hydroxy-2-[(6-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)methyl]-5-(hydroxymethyl)cyclohexa-2,5-diene-1,4-dione

1 reference

based on heuristic

inferred from SMILES

mass

374.20932406 dalton

1 reference

1 reference

C₂₂H₃₀O₅

0 references

canonical SMILES

O=C1C=C(C(=O)C(O)=C1CC2C(=C)CCC3C(C)(C)C(O)CCC23C)CO

0 references

isomeric SMILES

C=C1CC[C@H]2C(C)(C)[C@H](O)CC[C@@]2(C)[C@H]1CC1=C(O)C(=O)C(CO)=CC1=O

0 references

found in taxon

Phyllosticta spinarum

1 reference

stated in

Sesquiterpene quinones and related metabolites from Phyllosticta spinarum, a fungal strain endophytic in Platycladus orientalis of the Sonoran Desert

Identifiers

InChI

InChI=1S/C22H30O5/c1-12-5-6-17-21(2,3)18(25)7-8-22(17,4)15(12)10-14-16(24)9-13(11-23)19(26)20(14)27/h9,15,17-18,23,25,27H,1,5-8,10-11H2,2-4H3/t15-,17-,18+,22-/m0/s1

0 references

InChIKey

BJEQCQQYHRYXQG-FCQWJQKHSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

BJEQCQQYHRYXQG-FCQWJQKHSA-N

(Q104937038)

2-[[(1S,4aR,6R,8aS)-6-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methyl]-3-hydroxy-5-(hydroxymethyl)cyclohexa-2,5-diene-1,4-dione

Statements

Identifiers

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