(Q105141069)

English

N-[(3S,6S,7S,10S,14R,15S)-15-benzyl-14-hydroxy-3,7,13,13-tetramethyl-2,5,9,12-tetraoxo-10-propan-2-yl-1,4,8,11-tetraoxacyclopentadec-6-yl]-3-formamido-2-hydroxybenzamide

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

macrolides

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mass

656.25812472 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₃H₄₀N₂O₁₂

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canonical SMILES

CC1OC(=O)C(NC(=O)c2cccc(NC=O)c2O)C(C)OC(=O)C(C(C)C)OC(=O)C(C)(C)C(O)C(Cc2ccccc2)OC1=O

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isomeric SMILES

CC(C)[C@@H]1OC(=O)C(C)(C)[C@@H](O)[C@H](Cc2ccccc2)OC(=O)[C@H](C)OC(=O)[C@@H](NC(=O)c2cccc(NC=O)c2O)[C@H](C)OC1=O

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found in taxon

Streptomyces

1 reference

stated in

SW-163A and B, novel immunosuppressants produced by Streptomyces sp.

Identifiers

InChI

InChI=1S/C33H40N2O12/c1-17(2)26-31(42)44-18(3)24(35-28(39)21-13-10-14-22(25(21)37)34-16-36)30(41)45-19(4)29(40)46-23(15-20-11-8-7-9-12-20)27(38)33(5,6)32(43)47-26/h7-14,16-19,23-24,26-27,37-38H,15H2,1-6H3,(H,34,36)(H,35,39)/t18-,19-,23-,24-,26-,27-/m0/s1

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InChIKey

KHAIDUWWKKROCZ-YVTBCLTRSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KHAIDUWWKKROCZ-YVTBCLTRSA-N

(Q105141069)

N-[(3S,6S,7S,10S,14R,15S)-15-benzyl-14-hydroxy-3,7,13,13-tetramethyl-2,5,9,12-tetraoxo-10-propan-2-yl-1,4,8,11-tetraoxacyclopentadec-6-yl]-3-formamido-2-hydroxybenzamide

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Identifiers

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