Chem
J-GLOBAL ID:200907003721032018
Nikkaji number:J944.955H
4-Hydroxy-3′,4′-didehydro-β,ψ-carotene
4-ヒドロキシ-3′,4′-ジデヒドロ-β,ψ-カロテン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C40 H54 O
Molecular formula furigana:
C40-H54-O
Molecular weight:
550.871
InChI:
InChI=1S/C40H54O/c1-31(2)17-13-20-34(5)23-15-25-35(6)24-14-21-32(3)18-11-12-19-33(4)22-16-26-36(7)27-28-38-37(8)39(41)29-30-40(38,9)10/h11-28,39,41H,29-30H2,1-10H3/b12-11+,20-13?,21-14+,22-16+,25-15+,28-27+,32-18+,33-19+,34-23+,35-24+,36-26+
InChI key:
TZLKPGUJLALBPG-OVDRATAQSA-N
SMILES:
CC(=CC=C/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)C(O)CCC1(C)C)/C)/C)/C)C
Systematic name (3):
4-ヒドロキシ-3′,4′-ジデヒドロ-β,ψ-カロテン
3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E,19E)-3,7,12,16,20,24-ヘキサメチルペンタコサ-1,3,5,7,9,11,13,15,17,19,21,23-ドデカエン-1-イル]-2,4,4-トリメチルシクロヘキサ-2-エン-1-オール
3-[(1E,3E,5E,7E,9E,11E,13E,15E,17E,19E)-3,7,12,16,20,24-hexamethylpentacosa-1,3,5,7,9,11,13,15,17,19,21,23-dodecaen-1-yl]-2,4,4-trimethylcyclohex-2-en-1-ol
Other name (1):
4-Hydroxy-3′,4′-didehydro-β,ψ-carotene
Thsaurus map:
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