(Q104990574)

English

(3R,10aS)-10a-[[(1S,3S,6S)-3-chloro-6-hydroxy-2,2,6-trimethylcyclohexyl]methyl]-3,6,8-trihydroxy-2,2-dimethyl-4,4a-dihydro-3H-benzo[g]chromene-5,10-dione

group of stereoisomers with the chemical formula C₂₅H₃₃ClO₇

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

480.191481076 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₅H₃₃ClO₇

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canonical SMILES

O=C1C=2C(O)=CC(O)=CC2C(=O)C3(OC(C)(C)C(O)CC13)CC4C(O)(C)CCC(Cl)C4(C)C

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isomeric SMILES

CC1(C)[C@@H](Cl)CC[C@](C)(O)[C@H]1C[C@]12OC(C)(C)[C@H](O)CC1C(=O)c1c(O)cc(O)cc1C2=O

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found in taxon

Streptomyces

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stated in

New Napyradiomycin Analogues from Streptomyces sp. Strain CA-271078

Identifiers

InChI

InChI=1S/C25H33ClO7/c1-22(2)16(24(5,32)7-6-17(22)26)11-25-14(10-18(29)23(3,4)33-25)20(30)19-13(21(25)31)8-12(27)9-15(19)28/h8-9,14,16-18,27-29,32H,6-7,10-11H2,1-5H3/t14?,16-,17-,18+,24-,25-/m0/s1

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InChIKey

DWJVGNLWBNHYRR-LOOOOBCASA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DWJVGNLWBNHYRR-LOOOOBCASA-N

(Q104990574)

(3R,10aS)-10a-[[(1S,3S,6S)-3-chloro-6-hydroxy-2,2,6-trimethylcyclohexyl]methyl]-3,6,8-trihydroxy-2,2-dimethyl-4,4a-dihydro-3H-benzo[g]chromene-5,10-dione

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Identifiers

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