(Q104979291)

English

N-[(6S,7S)-3-Butan-2-yl-7,10,10-trimethyl-12-(2-methylpropyl)-2,5,9,11-tetraoxo-1,4,8-trioxacyclododec-6-yl]-3-formamido-2-hydroxybenzamide

group of stereoisomers with the chemical formula C₂₈H₃₈N₂O₁₀

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Statements

instance of

group of stereoisomers

0 references

1 reference

562.252645416 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₃₈N₂O₁₀

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canonical SMILES

CCC(C)C1OC(=O)C(NC(=O)c2cccc(NC=O)c2O)C(C)OC(=O)C(C)(C)C(=O)C(CC(C)C)OC1=O

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isomeric SMILES

CCC(C)C1OC(=O)[C@@H](NC(=O)c2cccc(NC=O)c2O)[C@H](C)OC(=O)C(C)(C)C(=O)C(CC(C)C)OC1=O

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found in taxon

Streptomyces

1 reference

stated in

A novel antimycin-like compound, JBIR-06, from Streptomyces sp. ML55.

Identifiers

InChI

InChI=1S/C28H38N2O10/c1-8-15(4)22-26(36)39-19(12-14(2)3)23(33)28(6,7)27(37)38-16(5)20(25(35)40-22)30-24(34)17-10-9-11-18(21(17)32)29-13-31/h9-11,13-16,19-20,22,32H,8,12H2,1-7H3,(H,29,31)(H,30,34)/t15?,16-,19?,20-,22?/m0/s1

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InChIKey

DGUFUEHCXSEKMT-GBCVEWGJSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DGUFUEHCXSEKMT-GBCVEWGJSA-N

ChEBI ID

197960

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C28H38N2O10/c1-8-15(4)22-26(36)39-19(12-14(2)3)23(33)28(6,7)27(37)38-16(5)20(25(35)40-22)30-24(34)17-10-9-11-18(21(17)32)29-13-31/h9-11,13-16,19-20,22,32H,8,12H2,1-7H3,(H,29,31)(H,30,34)/t15?,16-,19?,20-,22?/m0/s1

1 reference

Natural Product Atlas ID

NPA000485

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

DGUFUEHCXSEKMT-GBCVEWGJSA-N

(Q104979291)

N-[(6S,7S)-3-Butan-2-yl-7,10,10-trimethyl-12-(2-methylpropyl)-2,5,9,11-tetraoxo-1,4,8-trioxacyclododec-6-yl]-3-formamido-2-hydroxybenzamide

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