(Q27137240)

English

Streptobactin

chemical compound

Benzamide, N,N',N''-[[(2R,3S,6R,7S,10R,11S)-2,6,10-trimethyl-4,8,12-trioxo-1,5,9-trioxacyclododecane-3,7,11-triyl]tris[imino[(1S)-1-[3-[(aminoiminomethyl)amino]propyl]-2-oxo-2,1-ethanediyl]]]tris[2,3- dihydroxy-

In more languages

Statements

type of chemical entity

0 references

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1,179.495 dalton

1 reference

language of work or name

Streptobactin (English)

7 October 2016

chemical formula

C₅₁H₆₉N₁₅O₁₈

1 reference

language of work or name

Streptobactin (English)

7 October 2016

canonical SMILES

CC1C(C(=O)OC(C(C(=O)OC(C(C(=O)O1)NC(=O)C(CCCN=C(N)N)NC(=O)C2=C(C(=CC=C2)O)O)C)NC(=O)C(CCCN=C(N)N)NC(=O)C3=C(C(=CC=C3)O)O)C)NC(=O)C(CCCN=C(N)N)NC(=O)C4=C(C(=CC=C4)O)O

1 reference

language of work or name

Streptobactin (English)

7 October 2016

isomeric SMILES

C[C@@H]1[C@@H](C(=O)O[C@@H]([C@@H](C(=O)O[C@@H]([C@@H](C(=O)O1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)C2=C(C(=CC=C2)O)O)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)C3=C(C(=CC=C3)O)O)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)C4=C(C(=CC=C4)O)O

1 reference

language of work or name

Streptobactin (English)

7 October 2016

2 references

Gene cluster involved in the biosynthesis of griseobactin, a catechol-peptide siderophore of Streptomyces sp. ATCC 700974.

Streptobactin, a tricatechol-type siderophore from marine-derived Streptomyces sp. YM5-799.

Identifiers

InChI=1S/C51H69N15O18/c1-22-34(64-43(76)28(13-7-19-58-49(52)53)61-40(73)25-10-4-16-31(67)37(25)70)46(79)83-24(3)36(66-45(78)30(15-9-21-60-51(56)57)63-42(75)27-12-6-18-33(69)39(27)72)48(81)84-23(2)35(47(80)82-22)65-44(77)29(14-8-20-59-50(54)55)62-41(74)26-11-5-17-32(68)38(26)71/h4-6,10-12,16-18,22-24,28-30,34-36,67-72H,7-9,13-15,19-21H2,1-3H3,(H,61,73)(H,62,74)(H,63,75)(H,64,76)(H,65,77)(H,66,78)(H4,52,53,58)(H4,54,55,59)(H4,56,57,60)/t22-,23-,24-,28+,29+,30+,34+,35+,36+/m1/s1

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WLSGYSOOUFLHHA-XKCQZYHGSA-N

2 references

language of work or name

Streptobactin (English)

7 October 2016

ChEBI release 2020-09-01

1 reference

language of work or name

streptobactin (English)

7 October 2016

2 references

language of work or name

Streptobactin (English)

7 October 2016

matched by identifier from

WLSGYSOOUFLHHA-XKCQZYHGSA-N

mapping relation type

2 references

language of work or name

Streptobactin (English)

7 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C51H69N15O18/c1-22-34(64-43(76)28(13-7-19-58-49(52)53)61-40(73)25-10-4-16-31(67)37(25)70)46(79)83-24(3)36(66-45(78)30(15-9-21-60-51(56)57)63-42(75)27-12-6-18-33(69)39(27)72)48(81)84-23(2)35(47(80)82-22)65-44(77)29(14-8-20-59-50(54)55)62-41(74)26-11-5-17-32(68)38(26)71/h4-6,10-12,16-18,22-24,28-30,34-36,67-72H,7-9,13-15,19-21H2,1-3H3,(H,61,73)(H,62,74)(H,63,75)(H,64,76)(H,65,77)(H,66,78)(H4,52,53,58)(H4,54,55,59)(H4,56,57,60)/t22-,23-,24-,28+,29+,30+,34+,35+,36+/m1/s1

UniChem compound ID

1 reference

Natural Product Atlas ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

WLSGYSOOUFLHHA-XKCQZYHGSA-N

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