(Q105348786)

English

(7E,9S,10S,11R,12R,13R,14R,15R,16S,17S,18E)-4,10,12,14,16-pentahydroxy-3,7,9,11,13,15,17,25-octamethyl-23-azatricyclo[22.3.1.05,27]octacosa-1(27),2,4,7,18,20,24-heptaene-6,22,26,28-tetrone

chemical compound

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instance of

type of chemical entity

0 references

subclass of

chemical compound

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mass

623.30943202 dalton

1 reference

1 reference

(7E,9S,10S,11R,12R,13R,14R,15R,16S,17S,18E,20E)-4,10,12,14,16-pentahydroxy-3,7,9,11,13,15,17,25-octamethyl-23-azatricyclo[22.3.1.05,27]octacosa-1(27),2,4,7,18,20,24-heptaene-6,22,26,28-tetrone

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₅H₄₅NO₉

0 references

canonical SMILES

CC1=CC(C)C(O)C(C)C(O)C(C)C(O)C(C)C(O)C(C)C=CC=CC(=O)NC2=C(C)C(=O)c3c(cc(C)c(O)c3C1=O)C2=O

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isomeric SMILES

CC1=C2NC(=O)C=C/C=C/[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](O)[C@H](C)[C@@H](O)[C@@H](C)/C=C(\C)C(=O)c3c(O)c(C)cc(c3C1=O)C2=O

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found in taxon

Streptomyces

1 reference

stated in

Chaxamycins A-D, bioactive ansamycins from a hyper-arid desert Streptomyces sp.

Identifiers

InChI

InChI=1S/C35H45NO9/c1-15-11-9-10-12-24(37)36-27-19(5)34(44)25-23(35(27)45)14-18(4)31(41)26(25)30(40)17(3)13-16(2)29(39)21(7)33(43)22(8)32(42)20(6)28(15)38/h9-16,20-22,28-29,32-33,38-39,41-43H,1-8H3,(H,36,37)/b11-9+,12-10?,17-13+/t15-,16-,20+,21+,22+,28-,29-,32+,33+/m0/s1

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InChIKey

YIELQFCSZNNHLS-BIELUONUSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YIELQFCSZNNHLS-BIELUONUSA-N

(Q105348786)

(7E,9S,10S,11R,12R,13R,14R,15R,16S,17S,18E)-4,10,12,14,16-pentahydroxy-3,7,9,11,13,15,17,25-octamethyl-23-azatricyclo[22.3.1.05,27]octacosa-1(27),2,4,7,18,20,24-heptaene-6,22,26,28-tetrone

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Identifiers

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