(Q105162129)

English

(S,Z)-3-((E)-2-((1R,3aS,7aR)-1-((2R,5R,E)-5,6-dimethylhept-3-en-2-yl)-7a-methyldihydro-1H-inden-4(2H,5H,6H,7H,7aH)-ylidene)ethylidene)-4-methylenecyclohexanol

chemical compound

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Statements

instance of

type of chemical entity

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1 reference

396.339216028 dalton

1 reference

2 references

inferred from InChIKey

1 reference

C₂₈H₄₄O

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canonical SMILES

OC1CC(=CC=C2CCCC3(C)C2CCC3C(C=CC(C)C(C)C)C)C(=C)CC1

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isomeric SMILES

C=C1CC[C@H](O)CC1=CC=C1CCC[C@@]2(C)[C@H]1CC[C@@H]2[C@H](C)/C=C/[C@H](C)C(C)C

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found in taxon

Homo sapiens

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stated in

The human saliva metabolome

stated in

A community-driven global reconstruction of human metabolism.

Identifiers

InChI

InChI=1S/C28H44O/c1-19(2)20(3)9-10-22(5)26-15-16-27-23(8-7-17-28(26,27)6)12-13-24-18-25(29)14-11-21(24)4/h9-10,12-13,19-20,22,25-27,29H,4,7-8,11,14-18H2,1-3,5-6H3/b10-9+,23-12?,24-13?/t20-,22+,25-,26+,27-,28+/m0/s1

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InChIKey

MECHNRXZTMCUDQ-FKHYFIEFSA-N

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1 reference

17 September 2022

inferred from InChIKey

1 reference

(Q105162129)

(S,Z)-3-((E)-2-((1R,3aS,7aR)-1-((2R,5R,E)-5,6-dimethylhept-3-en-2-yl)-7a-methyldihydro-1H-inden-4(2H,5H,6H,7H,7aH)-ylidene)ethylidene)-4-methylenecyclohexanol

Statements

Identifiers

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