Chem
J-GLOBAL ID:200907013437664131
Nikkaji number:J10.097H
Rhodoxanthin
ロドキサンチン
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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 H50 O2
Molecular formula furigana:
C40-H50-O2
Molecular weight:
562.838
InChI:
InChI=1S/C40H50O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-26H,27-28H2,1-10H3/b15-11+,16-12+,19-13+,20-14+,29-17+,30-18+,31-21+,32-22+,37-23?,38-24?
InChI key:
VWXMLZQUDPCJPL-VJGOHDGESA-N
SMILES:
C/C(=C\C=C\C(=C\C=C1C(=CC(=O)CC1(C)C)C)\C)/C=C/C=C/C(=C/C=C/C(=C/C=C1C(=CC(=O)CC1(C)C)C)/C)/C
Systematic name (4):
6,6′-ジデヒドロ-ε,ε-カロテン-3,3′-ジオン
4′,5′-ジデヒドロ-4,5′-レトロ-β,β-カロテン-3,3′-ジオン
3,5,5-トリメチル-4-[(2E,4E,6E,8E,10E,12E,14E,16E)-3,7,12,16-テトラメチル-18-(2,6,6-トリメチル-4-オキソシクロヘキサ-2-エン-1-イリデン)オクタデカ-2,4,6,8,10,12,14,16-オクタエン-1-イリデン]シクロヘキサ-2-エン-1-オン
3,5,5-trimethyl-4-[(2E,4E,6E,8E,10E,12E,14E,16E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethyl-4-oxocyclohex-2-en-1-ylidene)octadeca-2,4,6,8,10,12,14,16-octaen-1-ylidene]cyclohex-2-en-1-one
Other name (3):
ロドキサンチン
Rhodoxanthin
4′,5′-Didehydro-4,5′-retro-β,β-carotene-3,3′-dione
CAS registry number:
116-30-3
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