(Q104395965)

English

[(2S)-1-[3,10-dihydroxy-12-[(2S)-2-(4-hydroxyphenoxy)carbonyloxypropyl]-2,6,7,11-tetramethoxy-4,9-dioxoperylen-1-yl]propan-2-yl] benzoate

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

790.226155896 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₄₄H₃₈O₁₄

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canonical SMILES

O=C(OC1=CC=C(O)C=C1)OC(C)CC2=C(OC)C(O)=C3C(=O)C=C(OC)C4=C5C(OC)=CC(=O)C=6C(O)=C(OC)C(=C(C65)C2=C34)CC(OC(=O)C=7C=CC=CC7)C

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isomeric SMILES

COc1c(O)c2c(=O)cc(OC)c3c4c(OC)cc(=O)c5c(O)c(OC)c(C[C@H](C)OC(=O)c6ccccc6)c(c(c1C[C@H](C)OC(=O)Oc1ccc(O)cc1)c23)c54

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found in taxon

Cladosporium cladosporioides

1 reference

stated in

Calphostins (UCN-1028), novel and specific inhibitors of protein kinase C. I. Fermentation, isolation, physico-chemical properties and biological activities

Identifiers

InChI

InChI=1S/C44H38O14/c1-20(56-43(50)22-10-8-7-9-11-22)16-25-31-32-26(17-21(2)57-44(51)58-24-14-12-23(45)13-15-24)42(55-6)40(49)34-28(47)19-30(53-4)36(38(32)34)35-29(52-3)18-27(46)33(37(31)35)39(48)41(25)54-5/h7-15,18-21,45,48-49H,16-17H2,1-6H3/t20-,21-/m0/s1

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InChIKey

LSUTUUOITDQYNO-SFTDATJTSA-N

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1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q104395965)

[(2S)-1-[3,10-dihydroxy-12-[(2S)-2-(4-hydroxyphenoxy)carbonyloxypropyl]-2,6,7,11-tetramethoxy-4,9-dioxoperylen-1-yl]propan-2-yl] benzoate

Statements

Identifiers

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