(Q104170704)

English

5-[11,21-Dihydroxy-7,7,9,9,17,18,22-heptamethyl-13-(3-methylbut-2-enyl)-8-oxa-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.017,26.018,23]heptacosa-1(16),2,4(12),5,13-pentaen-22-yl]-2-methylpenta-2,4-dienoic acid

group of stereoisomers with the chemical formula C₄₃H₅₇NO₅

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instance of

group of stereoisomers

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subclass of

2,3,6-trimethylheptane monoterpenoid

1 reference

inferred from

2,3,6-trimethylheptane monoterpenoid

1 reference

667.4236739240001 dalton

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based on heuristic

inferred from InChI

chemical formula

C₄₃H₅₇NO₅

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canonical SMILES

O=C(O)C(=CC=CC1(C)C(O)CCC2(C)C1CCC3CC=4C5=CC=6C7=CC(OC(C)(C)C7C(O)C6C(=C5NC4C32C)CC=C(C)C)(C)C)C

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Identifiers

InChI

InChI=1S/C43H57NO5/c1-23(2)13-15-26-33-27(30-22-39(4,5)49-40(6,7)34(30)36(33)46)21-28-29-20-25-14-16-31-41(8,18-11-12-24(3)38(47)48)32(45)17-19-42(31,9)43(25,10)37(29)44-35(26)28/h11-13,18,21-22,25,31-32,34,36,44-46H,14-17,19-20H2,1-10H3,(H,47,48)

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InChIKey

KYJMIMWHTSJVQB-UHFFFAOYSA-N

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PubChem CID

73812735

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

KYJMIMWHTSJVQB-UHFFFAOYSA-N

(Q104170704)

5-[11,21-Dihydroxy-7,7,9,9,17,18,22-heptamethyl-13-(3-methylbut-2-enyl)-8-oxa-15-azaheptacyclo[14.11.0.02,14.04,12.05,10.017,26.018,23]heptacosa-1(16),2,4(12),5,13-pentaen-22-yl]-2-methylpenta-2,4-dienoic acid

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