(Q104998954)

English

(1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E,19E,21Z)-24-hydroxy-3,7,12,16,20,24-hexamethylpentacosa-1,3,5,7,9,11,13,15,17,19,21-undecaenyl]-3,5,5-trimethylcyclohex-3-en-1-ol

chemical compound

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type of chemical entity

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subclass of

4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-24-hydroxy-3,7,12,16,20,24-hexamethylpentacosa-1,3,5,7,9,11,13,15,17,19,21-undecaen-1-yl]-3,5,5-trimethylcyclohex-3-en-1-ol

1 reference

based on heuristic

inferred from SMILES

mass

568.428031032 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₀H₅₆O₂

0 references

canonical SMILES

OC1CC(=C(C=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC=C(C=CCC(O)(C)C)C)C)C)C)C)C(C)(C)C1)C

0 references

isomeric SMILES

CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C=C(C)/C=C\CC(C)(C)O)C(C)(C)C[C@H](O)C1

0 references

found in taxon

Saprospira grandis

2 references

stated in

The Carotenoids of Flexibacteria. II. A New Xanthophyll from Saprospira grandis.

stated in

The carotenoids of flexibacteria. 2. A new xanthophyll from Saprospira grandis

Identifiers

InChI

InChI=1S/C40H56O2/c1-31(19-13-21-33(3)22-14-23-34(4)25-16-28-40(9,10)42)17-11-12-18-32(2)20-15-24-35(5)26-27-38-36(6)29-37(41)30-39(38,7)8/h11-27,37,41-42H,28-30H2,1-10H3/b12-11+,19-13+,20-15+,22-14+,25-16-,27-26+,31-17+,32-18+,33-21+,34-23+,35-24+/t37-/m1/s1

0 references

InChIKey

FOUGFFVPRFFMLC-JTCFSRCXSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

FOUGFFVPRFFMLC-JTCFSRCXSA-N

(Q104998954)

(1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E,19E,21Z)-24-hydroxy-3,7,12,16,20,24-hexamethylpentacosa-1,3,5,7,9,11,13,15,17,19,21-undecaenyl]-3,5,5-trimethylcyclohex-3-en-1-ol

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Identifiers

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