(Q104171269)

English

17-[5-[(3-chloro-1H-pyrrole-2-carbonyl)amino]-4-hydroxy-6-methyloxan-2-yl]oxy-3,22-diethyl-23-hydroxy-6,8,18-trimethyl-25,27-dioxo-26-oxapentacyclo[22.2.1.01,6.013,22.016,21]heptacosa-4,7,10,14,23-pentaene-4-carboxylic acid

group of stereoisomers with the chemical formula C₄₅H₅₇ClN₂O₁₀

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instance of

group of stereoisomers

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1 reference

820.3701737040003 dalton

1 reference

based on heuristic

inferred from InChI

chemical formula

C₄₅H₅₇ClN₂O₁₀

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canonical SMILES

CCC1CC23OC(=O)C(=C(O)C4(CC)C(C=CC5C(OC6CC(O)C(NC(=O)c7[nH]ccc7Cl)C(C)O6)C(C)CCC54)CC=CCC(C)=CC2(C)C=C1C(=O)O)C3=O

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Identifiers

InChI

InChI=1S/C45H57ClN2O10/c1-7-26-21-45-39(51)34(42(55)58-45)38(50)44(8-2)27(12-10-9-11-23(3)20-43(45,6)22-29(26)41(53)54)14-15-28-30(44)16-13-24(4)37(28)57-33-19-32(49)35(25(5)56-33)48-40(52)36-31(46)17-18-47-36/h9-10,14-15,17-18,20,22,24-28,30,32-33,35,37,47,49-50H,7-8,11-13,16,19,21H2,1-6H3,(H,48,52)(H,53,54)

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InChIKey

LSANQCYQTPFAGU-UHFFFAOYSA-N

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PubChem CID

76181155

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

LSANQCYQTPFAGU-UHFFFAOYSA-N

(Q104171269)

17-[5-[(3-chloro-1H-pyrrole-2-carbonyl)amino]-4-hydroxy-6-methyloxan-2-yl]oxy-3,22-diethyl-23-hydroxy-6,8,18-trimethyl-25,27-dioxo-26-oxapentacyclo[22.2.1.01,6.013,22.016,21]heptacosa-4,7,10,14,23-pentaene-4-carboxylic acid

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