(Q105147400)

English

13-Ethenyl-19-hydroxy-5,7,9,11-tetramethyl-2-oxa-18-azahexacyclo[19.2.2.13,10.116,19.04,9.014,27]heptacosa-1(23),11,16(26),21,24-pentaene-15,17-dione

group of stereoisomers with the chemical formula C₃₁H₃₇NO₄

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instance of

group of stereoisomers

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1 reference

487.27225866399993 dalton

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based on heuristic

inferred from InChI

chemical formula

C₃₁H₃₇NO₄

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canonical SMILES

C=CC1C=C(C)C2C3C(Oc4ccc(cc4)CC4(O)C=C(C(=O)N4)C(=O)C13)C1C(C)CC(C)CC21C

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found in taxon

Neonectria ramulariae

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stated in

Pyrrospirones A and B, apoptosis inducers in HL-60 cells, from an endophytic fungus, Neonectria ramulariae Wollenw KS-246.

Identifiers

InChI

InChI=1S/C31H37NO4/c1-6-20-12-18(4)25-24-23(20)27(33)22-15-31(35,32-29(22)34)14-19-7-9-21(10-8-19)36-28(24)26-17(3)11-16(2)13-30(25,26)5/h6-10,12,15-17,20,23-26,28,35H,1,11,13-14H2,2-5H3,(H,32,34)

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InChIKey

KXMGXXHZDLJDBH-UHFFFAOYSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

KXMGXXHZDLJDBH-UHFFFAOYSA-N

1 reference

(Q105147400)

13-Ethenyl-19-hydroxy-5,7,9,11-tetramethyl-2-oxa-18-azahexacyclo[19.2.2.13,10.116,19.04,9.014,27]heptacosa-1(23),11,16(26),21,24-pentaene-15,17-dione

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