(Q105298145)

English

(7S,8S)-5-chloro-7-hydroxy-8-[(3S,4S)-4-hydroxy-3-methyl-2-oxopentyl]-3-[(3R,4R)-4-hydroxy-3-methylpent-1-enyl]-7-methyl-8H-isochromen-6-one

chemical compound

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instance of

type of chemical entity

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subclass of

5-chloro-7-hydroxy-8-(4-hydroxy-3-methyl-2-oxopentyl)-3-(4-hydroxy-3-methylpent-1-en-1-yl)-7-methyl-8H-isochromen-6-one

1 reference

based on heuristic

inferred from SMILES

mass

424.165266328 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₂H₂₉ClO₆

0 references

canonical SMILES

O=C1C(Cl)=C2C=C(OC=C2C(CC(=O)C(C)C(O)C)C1(O)C)C=CC(C)C(O)C

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isomeric SMILES

C[C@H](O)[C@H](C)C(=O)C[C@H]1C2=COC(C=C[C@@H](C)[C@@H](C)O)=CC2=C(Cl)C(=O)[C@@]1(C)O

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found in taxon

Chaetomium globosum

1 reference

stated in

New class azaphilone produced by a marine fish-derived Chaetomium globosum. The stereochemistry and biological activities

Identifiers

InChI

InChI=1S/C22H29ClO6/c1-11(13(3)24)6-7-15-8-16-17(10-29-15)18(9-19(26)12(2)14(4)25)22(5,28)21(27)20(16)23/h6-8,10-14,18,24-25,28H,9H2,1-5H3/t11-,12+,13-,14+,18+,22+/m1/s1

0 references

InChIKey

VWKWLVNURGSWPO-IQJSOLJHSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VWKWLVNURGSWPO-IQJSOLJHSA-N

(Q105298145)

(7S,8S)-5-chloro-7-hydroxy-8-[(3S,4S)-4-hydroxy-3-methyl-2-oxopentyl]-3-[(3R,4R)-4-hydroxy-3-methylpent-1-enyl]-7-methyl-8H-isochromen-6-one

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Identifiers

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