(Q105116499)

English

(3S,6R,12S,14E,16R,18S)-6-[(3-bromo-4-hydroxyphenyl)methyl]-3,7,12,14,16,18-hexamethyl-1-oxa-4,7,10-triazacyclooctadec-14-ene-2,5,8,11-tetrone

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(3R,14E,16S,18R)-6-[(3-bromo-4-hydroxyphenyl)methyl]-5,11-dihydroxy-3,7,12,14,16,18-hexamethyl-1-oxa-4,7,10-triazacyclooctadeca-4,10,14-triene-2,8-dione

1 reference

based on heuristic

inferred from SMILES

mass

579.194398036 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₇H₃₈BrN₃O₆

0 references

canonical SMILES

CC1=CC(C)CC(C)OC(=O)C(C)NC(=O)C(Cc2ccc(O)c(Br)c2)N(C)C(=O)CNC(=O)C(C)C1

0 references

isomeric SMILES

C/C1=C\[C@H](C)C[C@H](C)OC(=O)[C@H](C)NC(=O)[C@@H](Cc2ccc(O)c(Br)c2)N(C)C(=O)CNC(=O)[C@@H](C)C1

0 references

found in taxon

Axinyssa

1 reference

stated in

Geodiamolides C to F, new cytotoxic cyclodepsipeptides from the marine sponge Pseudaxinyssa sp.

Identifiers

InChI

InChI=1S/C27H38BrN3O6/c1-15-9-16(2)11-18(4)37-27(36)19(5)30-26(35)22(13-20-7-8-23(32)21(28)12-20)31(6)24(33)14-29-25(34)17(3)10-15/h7-9,12,16-19,22,32H,10-11,13-14H2,1-6H3,(H,29,34)(H,30,35)/b15-9+/t16-,17-,18-,19-,22+/m0/s1

0 references

InChIKey

INYUFROKXKFBJE-ACWJOKAYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

INYUFROKXKFBJE-ACWJOKAYSA-N

1 reference

(Q105116499)

(3S,6R,12S,14E,16R,18S)-6-[(3-bromo-4-hydroxyphenyl)methyl]-3,7,12,14,16,18-hexamethyl-1-oxa-4,7,10-triazacyclooctadec-14-ene-2,5,8,11-tetrone

Statements

Identifiers

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